Vitas-M small molecule compound
methyl {5-amino-6-cyano-7-(3-methoxyphenyl)-8-[(4-methylphenyl)carbamoyl]-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridin-2-yl}acetate
Catalog ID
STL447682
SMILES COC(=O)CC1SC2=C(C(=O)Nc3ccc(cc3)C)C(C(=C(N2C1=O)N)C#N)c1cccc(c1)OC
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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 C26H24N4O5S MW 504.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N4O5S/c1-14-7-9-16(10-8-14)29-24(32)22-21(15-5-4-6-17(11-15)34-2)18(13-27)23(28)30-25(33)19(36-26(22)30)12-20(31)35-3/h4-11,19,21H,12,28H2,1-3H3,(H,29,32)InChIKey
FRCPUOJNJZNRKL-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)NC(=O)C2=C3N(C(=O)C(S3)CC(=O)OC)C(=C(C2C4=CC(=CC=C4)OC)C#N)N
InChI=1SC26H24N4O5Sc1147916(10814)2924(32)2221(1554617(1115)342)18(1327)23(28)3025(33)19(3626(22)30)1220(31)353h4111921H1228H213H3(H2932)
methyl(5amino6cyano7(3methoxyphenyl)8((4methylphenyl)carbamoyl)3oxo23dihydro7H(13)thiazolo(32a)pyridin2yl)acetate
METHYL2(5AMINO6CYANO7(3METHOXYPHENYL)3OXO8(PTOLYLCARBAMOYL)37DIHYDRO2HTHIAZOLO(32A)PYRIDIN2YL)ACETATE
METHYL2(5AMINO6CYANO7(3METHOXYPHENYL)8((4METHYLPHENYL)CARBAMOYL)3OXO7H(13)THIAZOLO(32A)PYRIDIN2YL)ACETATE
MFCD06242184
ZINC000003770017
ZINC000003770020
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