Vitas-M small molecule compound
methyl (2Z)-[5-amino-6-cyano-7-(4-methoxyphenyl)-8-[(4-methoxyphenyl)carbamoyl]-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridin-2(3H)-ylidene]ethanoate
Catalog ID
STL485437
SMILES COc1ccc(cc1)NC(=O)C1=c2s/c(=C\C(=O)OC)/c(=O)n2C(=C(C1c1ccc(cc1)OC)C#N)N
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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 C26H22N4O6S MW 518.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N4O6S/c1-34-16-8-4-14(5-9-16)21-18(13-27)23(28)30-25(33)19(12-20(31)36-3)37-26(30)22(21)24(32)29-15-6-10-17(35-2)11-7-15/h4-12,21H,28H2,1-3H3,(H,29,32)/b19-12-InChIKey
KJBAUIHVYNBRSK-UNOMPAQXSA-NSynonyms
COC1=CC=C(C=C1)C2C(=C(N3C(=C2C(=O)NC4=CC=C(C=C4)OC)SC(=CC(=O)OC)C3=O)N)C#N
COc1ccc(cc1)NC(=O)C1=c2sc(=CC(=O)OC)c(=O)n2C(=C(C1c1ccc(cc1)OC)C#N)N
InChI=1SC26H22N4O6Sc134168414(5916)2118(1327)23(28)3025(33)19(1220(31)363)3726(30)22(21)24(32)291561017(352)11715h41221H28H213H3(H2932)b1912
methyl(2Z)(5amino6cyano7(4methoxyphenyl)8((4methoxyphenyl)carbamoyl)3oxo7H(13)thiazolo(32a)pyridin2(3H)ylidene)ethanoate
METHYL(2Z)2(5AMINO6CYANO7(4METHOXYPHENYL)8((4METHOXYPHENYL)CARBAMOYL)3OXO7H(13)THIAZOLO(32A)PYRIDIN2YLIDENE)ACETATE
MFCD07773463
ZINC000003764647
ZINC000003764649
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