Vitas-M small molecule compound
methyl 2-({(1Z)-2-cyano-3-[(4-methoxyphenyl)amino]-3-oxoprop-1-en-1-yl}amino)benzoate
Catalog ID
STK715967
SMILES COc1ccc(cc1)NC(=O)/C(=C\Nc1ccccc1C(=O)OC)/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 C19H17N3O4 MW 351.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N3O4/c1-25-15-9-7-14(8-10-15)22-18(23)13(11-20)12-21-17-6-4-3-5-16(17)19(24)26-2/h3-10,12,21H,1-2H3,(H,22,23)/b13-12-InChIKey
CNJYFQUVBQPHMW-SEYXRHQNSA-NSynonyms
(E)methyl2((2cyano3((4methoxyphenyl)amino)3oxoprop1en1yl)amino)benzoate
COC1=CC=C(C=C1)NC(=O)C(=CNC2=CC=CC=C2C(=O)OC)C#N
COc1ccc(cc1)NC(=O)C(=CNc1ccccc1C(=O)OC)C#N
InChI=1SC19H17N3O4c125159714(81015)2218(23)13(1120)122117643516(17)19(24)262h3101221H12H3(H2223)b1312
methyl2(((1Z)2cyano3((4methoxyphenyl)amino)3oxoprop1en1yl)amino)benzoate
methyl2(((Z)2cyano3(4methoxyanilino)3oxoprop1enyl)amino)benzoate
MFCD07798114
ZINC000008995677
ZINC8995677
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