Vitas-M small molecule compound
methyl 2-(3-{(1Z)-3-[(2-chlorophenyl)amino]-2-cyano-3-oxoprop-1-en-1-yl}-2,5-dimethyl-1H-pyrrol-1-yl)benzoate
Catalog ID
STK183673
SMILES N#C/C(=C/c1cc(n(c1C)c1ccccc1C(=O)OC)C)/C(=O)Nc1ccccc1Cl
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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 C24H20ClN3O3 MW 433.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20ClN3O3/c1-15-12-17(13-18(14-26)23(29)27-21-10-6-5-9-20(21)25)16(2)28(15)22-11-7-4-8-19(22)24(30)31-3/h4-13H,1-3H3,(H,27,29)/b18-13-InChIKey
JIMHEYAKURQMJQ-AQTBWJFISA-NSynonyms
CC1=CC(=C(N1C2=CC=CC=C2C(=O)OC)C)C=C(C#N)C(=O)NC3=CC=CC=C3Cl
InChI=1SC24H20ClN3O3c1151217(1318(1426)23(29)27211065920(21)25)16(2)28(15)221174819(22)24(30)313h413H13H3(H2729)b1813
METHYL2(3((1Z)3((2CHLOROPHENYL)AMINO)2CYANO3OXOPROP1EN1YL)25DIMETHYL1HPYRROL1YL)BENZOATE
methyl2(3((Z)3(2chloroanilino)2cyano3oxoprop1enyl)25dimethylpyrrol1yl)benzoate
MFCD04366127
N#CC(=Cc1cc(n(c1C)c1ccccc1C(=O)OC)C)C(=O)Nc1ccccc1Cl
ZINC000019877325
ZINC19877325
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