Vitas-M small molecule compound
methyl (4Z)-4-{[1-(3-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-methyl-5-oxo-1-(prop-2-en-1-yl)-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK168566
SMILES C=CCN1C(=O)/C(=C\c2cc(n(c2C)c2cccc(c2)Cl)C)/C(=C1C)C(=O)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 C23H23ClN2O3 MW 410.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23ClN2O3/c1-6-10-25-16(4)21(23(28)29-5)20(22(25)27)12-17-11-14(2)26(15(17)3)19-9-7-8-18(24)13-19/h6-9,11-13H,1,10H2,2-5H3/b20-12-InChIKey
GERJGFYVQXNXFF-NDENLUEZSA-NSynonyms
C=CCN1C(=O)C(=Cc2cc(n(c2C)c2cccc(c2)Cl)C)C(=C1C)C(=O)OC
CC1=CC(=C(N1C2=CC(=CC=C2)Cl)C)C=C3C(=C(N(C3=O)CC=C)C)C(=O)OC
InChI=1SC23H23ClN2O3c16102516(4)21(23(28)295)20(22(25)27)12171114(2)26(15(17)3)1997818(24)1319h691113H110H225H3b2012
METHYL(4Z)4((1(3CHLOROPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)2METHYL5OXO1(PROP2EN1YL)45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL(4Z)4((1(3CHLOROPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)2METHYL5OXO1PROP2ENYLPYRROLE3CARBOXYLATE
METHYL1ALLYL4((1(3CHLOROPHENYL)25DIMETHYL1HPYRROL3YL)METHYLENE)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD02954481
ZINC000014010596
ZINC14010596
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