Vitas-M small molecule compound
4-(3-{(1Z)-2-cyano-3-[(4-methoxyphenyl)amino]-3-oxoprop-1-en-1-yl}-2,5-dimethyl-1H-pyrrol-1-yl)benzoic acid
Catalog ID
STK397000
SMILES COc1ccc(cc1)NC(=O)/C(=C\c1cc(n(c1C)c1ccc(cc1)C(=O)O)C)/C#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 C24H21N3O4 MW 415.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N3O4/c1-15-12-18(16(2)27(15)21-8-4-17(5-9-21)24(29)30)13-19(14-25)23(28)26-20-6-10-22(31-3)11-7-20/h4-13H,1-3H3,(H,26,28)(H,29,30)/b19-13-InChIKey
LVPXLGVHWAMZOE-UYRXBGFRSA-NSynonyms
(Z)4(3(2cyano3((4methoxyphenyl)amino)3oxoprop1en1yl)25dimethyl1Hpyrrol1yl)benzoicacid
4(3((1Z)2CYANO2(N(4METHOXYPHENYL)CARBAMOYL)VINYL)25DIMETHYLPYRROLYL)BENZOICACID
4(3((1Z)2cyano3((4methoxyphenyl)amino)3oxoprop1en1yl)25dimethyl1Hpyrrol1yl)benzoicacid
4(3((Z)2CYANO3(4METHOXYANILINO)3OXOPROP1ENYL)25DIMETHYLPYRROL1YL)BENZOICACID
CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)O)C)C=C(C#N)C(=O)NC3=CC=C(C=C3)OC
COc1ccc(cc1)NC(=O)C(=Cc1cc(n(c1C)c1ccc(cc1)C(=O)O)C)C#N
InChI=1SC24H21N3O4c1151218(16(2)27(15)218417(5921)24(29)30)1319(1425)23(28)262061022(313)11720h413H13H3(H2628)(H2930)b1913
MFCD02378975
ZINC000001189922
ZINC1189922
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