Vitas-M small molecule compound
methyl (2Z)-[5-amino-6-cyano-7-(2,4-dimethoxyphenyl)-8-[(4-methoxyphenyl)carbamoyl]-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridin-2(3H)-ylidene]ethanoate
Catalog ID
STL485440
SMILES COc1ccc(cc1)NC(=O)C1=c2s/c(=C\C(=O)OC)/c(=O)n2C(=C(C1c1ccc(cc1OC)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 C27H24N4O7S MW 548.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24N4O7S/c1-35-15-7-5-14(6-8-15)30-25(33)23-22(17-10-9-16(36-2)11-19(17)37-3)18(13-28)24(29)31-26(34)20(39-27(23)31)12-21(32)38-4/h5-12,22H,29H2,1-4H3,(H,30,33)/b20-12-InChIKey
IJRHBJSTEYBPPC-NDENLUEZSA-NSynonyms
COC1=CC=C(C=C1)NC(=O)C2=C3N(C(=C(C2C4=C(C=C(C=C4)OC)OC)C#N)N)C(=O)C(=CC(=O)OC)S3
COc1ccc(cc1)NC(=O)C1=c2sc(=CC(=O)OC)c(=O)n2C(=C(C1c1ccc(cc1OC)OC)C#N)N
InChI=1SC27H24N4O7Sc135157514(6815)3025(33)2322(1710916(362)1119(17)373)18(1328)24(29)3126(34)20(3927(23)31)1221(32)384h51222H29H214H3(H3033)b2012
methyl(2Z)(5amino6cyano7(24dimethoxyphenyl)8((4methoxyphenyl)carbamoyl)3oxo7H(13)thiazolo(32a)pyridin2(3H)ylidene)ethanoate
METHYL(2Z)2(5AMINO6CYANO7(24DIMETHOXYPHENYL)8((4METHOXYPHENYL)CARBAMOYL)3OXO7H(13)THIAZOLO(32A)PYRIDIN2YLIDENE)ACETATE
MFCD07773465
ZINC000003764659
ZINC000003764661
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.