Vitas-M small molecule compound
methyl (5E)-5-{[2,5-dimethyl-1-(3-methylphenyl)-1H-pyrrol-3-yl]methylidene}-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK160907
SMILES COC(=O)C1=C(C)N/C(=C/c2cc(n(c2C)c2cccc(c2)C)C)/C1=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 C21H22N2O3 MW 350.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O3/c1-12-7-6-8-17(9-12)23-13(2)10-16(15(23)4)11-18-20(24)19(14(3)22-18)21(25)26-5/h6-11,22H,1-5H3/b18-11+InChIKey
JGIDGSZXJWEFGN-WOJGMQOQSA-NSynonyms
CC1=CC(=CC=C1)N2C(=CC(=C2C)C=C3C(=O)C(=C(N3)C)C(=O)OC)C
COC(=O)C1=C(C)NC(=Cc2cc(n(c2C)c2cccc(c2)C)C)C1=O
InChI=1SC21H22N2O3c11276817(912)2313(2)1016(15(23)4)111820(24)19(14(3)2218)21(25)265h61122H15H3b1811+
METHYL(5E)5((25DIMETHYL1(3METHYLPHENYL)1HPYRROL3YL)METHYLIDENE)2METHYL4OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL(5E)5((25DIMETHYL1(3METHYLPHENYL)PYRROL3YL)METHYLIDENE)2METHYL4OXO1HPYRROLE3CARBOXYLATE
MFCD04087207
ZINC000019859124
ZINC19859124
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