1. Primary Information
| English name: | Benzeneacetic acid, 4-(phosphonooxy)-, 1-((((((4-((5-((cyclopropylamino)carbonyl)-2-methylphenyl)amino)-5-methylpyrrolo(2,1-f)(1,2,4)triazin-6-yl)carbonyl)propylamino)carbonyl)oxy)methyl) ester |
| CAS No.: | 948842-66-8 |
| Molecular formula: | C32H35N6O10P |
| Molecular weight: | 694.6 g/mol |
| SMILES: | CCCN(C(=O)C1=CN2C(=C1C)C(=NC=N2)NC3=C(C=CC(=C3)C(=O)NC4CC4)C)C(=O)OCOC(=O)CC5=CC=C(C=C5)OP(=O)(O)O |
| Structural class: | |
| Other identifiers: |
((4-(5-(cyclopropylcarbamoyl)-2-methylphenylamino)-5-methylpyrrolo(1,2-f)(1,2,4)triazine-6-carbonyl)(propyl)carbamoyloxy)methyl-2-(4-(phosphonooxy)phenyl)acetate BMS-751324 |
2. Suppliers & Pricing
| Supplier | Pack size | Purity | Price (CNY) | Storage conditions | Lead time | Notes |
| Kehua Intelligence | 5mg | 98% | 960 | -20℃ | in stock | - |
| Kehua Intelligence | 10mg | 98% | 1600 | -20℃ | in stock | - |
| Kehua Intelligence | 25mg | 98% | 3200 | -20℃ | in stock | - |
| Kehua Intelligence | 50mg | 98% | 5200 | -20℃ | in stock | - |
3. Structures
3.1 2D structure
3.2 3D structure
4. International Nomenclature & Identifiers
4.1 IUPAC Name
[[4-[5-(cyclopropylcarbamoyl)-2-methylanilino]-5-methylpyrrolo[2,1-f][1,2,4]triazine-6-carbonyl]-propylcarbamoyl]oxymethyl 2-(4-phosphonooxyphenyl)acetate
4.2 InChI
InChI=1S/C32H35N6O10P/c1-4-13-37(32(42)47-18-46-27(39)14-21-6-11-24(12-7-21)48-49(43,44)45)31(41)25-16-38-28(20(25)3)29(33-17-34-38)36-26-15-22(8-5-19(26)2)30(40)35-23-9-10-23/h5-8,11-12,15-17,23H,4,9-10,13-14,18H2,1-3H3,(H,35,40)(H,33,34,36)(H2,43,44,45)
4.3 InChIKey
XAYQDTPEOFCYIG-UHFFFAOYSA-N
4.4 Canonical SMILES
CCCN(C(=O)C1=CN2C(=C1C)C(=NC=N2)NC3=C(C=CC(=C3)C(=O)NC4CC4)C)C(=O)OCOC(=O)CC5=CC=C(C=C5)OP(=O)(O)O
4.5 Isomeric SMILES
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