Vitas-M small molecule compound
methyl (2Z)-5-amino-6-cyano-2-(3-methoxybenzylidene)-7-(3-methoxyphenyl)-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-8-carboxylate
Catalog ID
STK871860
SMILES COc1cccc(c1)/C=c/1\sc2=C(C(=O)OC)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 C25H21N3O5S MW 475.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N3O5S/c1-31-16-8-4-6-14(10-16)11-19-23(29)28-22(27)18(13-26)20(15-7-5-9-17(12-15)32-2)21(24(28)34-19)25(30)33-3/h4-12,20H,27H2,1-3H3/b19-11-InChIKey
RDRDSANEZQUMDJ-ODLFYWEKSA-NSynonyms
(E)methyl5amino6cyano2(3methoxybenzylidene)7(3methoxyphenyl)3oxo37dihydro2Hthiazolo(32a)pyridine8carboxylate
COC1=CC=CC(=C1)C=C2C(=O)N3C(=C(C(C(=C3S2)C(=O)OC)C4=CC(=CC=C4)OC)C#N)N
COc1cccc(c1)C=c1sc2=C(C(=O)OC)C(C(=C(n2c1=O)N)C#N)c1cccc(c1)OC
InChI=1SC25H21N3O5Sc1311684614(1016)111923(29)2822(27)18(1326)20(1575917(1215)322)21(24(28)3419)25(30)333h41220H27H213H3b1911
methyl(2Z)5amino6cyano2(3methoxybenzylidene)7(3methoxyphenyl)3oxo23dihydro7H(13)thiazolo(32a)pyridine8carboxylate
METHYL(2Z)5AMINO6CYANO7(3METHOXYPHENYL)2((3METHOXYPHENYL)METHYLIDENE)3OXO7H(13)THIAZOLO(32A)PYRIDINE8CARBOXYLATE
MFCD01197799
ZINC000001516852
ZINC000001516856
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