Vitas-M small molecule compound
methyl 2-{[(7-benzyl-1,3-dimethyl-2,4-dioxo-2,3,4,7-tetrahydro-1H-pyrrolo[2,3-d]pyrimidin-6-yl)carbonyl]amino}benzoate
Catalog ID
STK979126
SMILES COC(=O)c1ccccc1NC(=O)c1cc2c(n1Cc1ccccc1)n(C)c(=O)n(c2=O)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C24H22N4O5 MW 446.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N4O5/c1-26-21-17(22(30)27(2)24(26)32)13-19(28(21)14-15-9-5-4-6-10-15)20(29)25-18-12-8-7-11-16(18)23(31)33-3/h4-13H,14H2,1-3H3,(H,25,29)InChIKey
BJPGQOAMOWUQEM-UHFFFAOYSA-NSynonyms
1021258-66-11021258661
CN1C2=C(C=C(N2CC3=CC=CC=C3)C(=O)NC4=CC=CC=C4C(=O)OC)C(=O)N(C1=O)C
InChI=1SC24H22N4O5c1262117(22(30)27(2)24(26)32)1319(28(21)141595461015)20(29)251812871116(18)23(31)333h413H14H213H3(H2529)
methyl2(((7benzyl13dimethyl24dioxo2347tetrahydro1Hpyrrolo(23d)pyrimidin6yl)carbonyl)amino)benzoate
methyl2((7benzyl13dimethyl24dioxopyrrolo(23d)pyrimidine6carbonyl)amino)benzoate
MFCD12006854
ZINC000011845046
ZINC11845046
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