Vitas-M small molecule compound
(2E)-3-(1-{4-[(4-chlorobenzyl)oxy]phenyl}-2,5-dimethyl-1H-pyrrol-3-yl)-2-cyano-N-(3-methylphenyl)prop-2-enamide
Catalog ID
STK183254
SMILES N#C/C(=C\c1cc(n(c1C)c1ccc(cc1)OCc1ccc(cc1)Cl)C)/C(=O)Nc1cccc(c1)C
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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 C30H26ClN3O2 MW 496.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26ClN3O2/c1-20-5-4-6-27(15-20)33-30(35)25(18-32)17-24-16-21(2)34(22(24)3)28-11-13-29(14-12-28)36-19-23-7-9-26(31)10-8-23/h4-17H,19H2,1-3H3,(H,33,35)/b25-17+InChIKey
BPDRCLOJYJHEGV-KOEQRZSOSA-NSynonyms
(2E)3(1(4((4CHLOROBENZYL)OXY)PHENYL)25DIMETHYL1HPYRROL3YL)2CYANON(3METHYLPHENYL)PROP2ENAMIDE
(E)3(1(4((4chlorophenyl)methoxy)phenyl)25dimethylpyrrol3yl)2cyanoN(3methylphenyl)prop2enamide
CC1=CC(=CC=C1)NC(=O)C(=CC2=C(N(C(=C2)C)C3=CC=C(C=C3)OCC4=CC=C(C=C4)Cl)C)C#N
InChI=1SC30H26ClN3O2c12054627(1520)3330(35)25(1832)17241621(2)34(22(24)3)28111329(141228)3619237926(31)10823h417H19H213H3(H3335)b2517+
MFCD02194130
N#CC(=Cc1cc(n(c1C)c1ccc(cc1)OCc1ccc(cc1)Cl)C)C(=O)Nc1cccc(c1)C
ZINC000009311788
ZINC09311788
ZINC9311788
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