Vitas-M small molecule compound

ethyl (2Z)-5-amino-8-cyano-3-oxo-2-(3-phenoxybenzylidene)-7-(3-phenoxyphenyl)-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6-carboxylate

Catalog ID
STK672938
SMILES CCOC(=O)C1=C(N)n2c(=C(C1c1cccc(c1)Oc1ccccc1)C#N)s/c(=C\c1cccc(c1)Oc1ccccc1)/c2=O

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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 C36H27N3O5S MW 613.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H27N3O5S/c1-2-42-36(41)32-31(24-12-10-18-28(21-24)44-26-15-7-4-8-16-26)29(22-37)35-39(33(32)38)34(40)30(45-35)20-23-11-9-17-27(19-23)43-25-13-5-3-6-14-25/h3-21,31H,2,38H2,1H3/b30-20-
InChIKey
FZMPGKILGGPPJO-COEJQBHMSA-N
Synonyms

CCOC(=O)C1=C(N)n2c(=C(C1c1cccc(c1)Oc1ccccc1)C#N)sc(=Cc1cccc(c1)Oc1ccccc1)c2=O
CCOC(=O)C1=C(N2C(=C(C1C3=CC(=CC=C3)OC4=CC=CC=C4)C#N)SC(=CC5=CC(=CC=C5)OC6=CC=CC=C6)C2=O)N
ethyl(2Z)5amino8cyano3oxo2(3phenoxybenzylidene)7(3phenoxyphenyl)23dihydro7H(13)thiazolo(32a)pyridine6carboxylate
ETHYL(2Z)5AMINO8CYANO3OXO7(3PHENOXYPHENYL)2((3PHENOXYPHENYL)METHYLIDENE)7H(13)THIAZOLO(32A)PYRIDINE6CARBOXYLATE
ETHYL5AMINO8CYANO3OXO2(3PHENOXYBENZYLIDENE)7(3PHENOXYPHENYL)23DIHYDRO7H(13)THIAZOLO(32A)PYRIDINE6CARBOXYLATE
InChI=1SC36H27N3O5Sc124236(41)3231(2412101828(2124)4426157481626)29(2237)3539(33(32)38)34(40)30(4535)20231191727(1923)4325135361425h32131H238H21H3b3020
MFCD00827061
ZINC000008443201
ZINC000008443202

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Available files

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