Vitas-M small molecule compound
prop-2-en-1-yl 7-methyl-2,4-dioxo-5-[4-(propan-2-yl)phenyl]-1,2,3,4,5,8-hexahydropyrido[2,3-d]pyrimidine-6-carboxylate
Catalog ID
STL091075
SMILES C=CCOC(=O)C1=C(C)Nc2c(C1c1ccc(cc1)C(C)C)c(=O)[nH]c(=O)[nH]2
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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 C21H23N3O4 MW 381.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O4/c1-5-10-28-20(26)15-12(4)22-18-17(19(25)24-21(27)23-18)16(15)14-8-6-13(7-9-14)11(2)3/h5-9,11,16H,1,10H2,2-4H3,(H3,22,23,24,25,27)InChIKey
DQYVEYUCFQOPPD-UHFFFAOYSA-NSynonyms
C=CCOC(=O)C1=C(C)Nc2c(C1c1ccc(cc1)C(C)C)c(=O)(nH)c(=O)(nH)2
CC1=C(C(C2=C(N1)NC(=O)NC2=O)C3=CC=C(C=C3)C(C)C)C(=O)OCC=C
InChI=1SC21H23N3O4c15102820(26)1512(4)221817(19(25)2421(27)2318)16(15)148613(7914)11(2)3h591116H110H224H3(H32223242527)
MFCD04425849
prop2en1yl7methyl24dioxo5(4(propan2yl)phenyl)123458hexahydropyrido(23d)pyrimidine6carboxylate
PROP2ENYL7METHYL24DIOXO5(4PROPAN2YLPHENYL)58DIHYDRO1HPYRIDO(23D)PYRIMIDINE6CARBOXYLATE
ZINC000006202405
ZINC000006202476
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