Vitas-M small molecule compound
(2E)-3-(4-tert-butylphenyl)-N-(4-chloro-2-methylphenyl)prop-2-enamide
Catalog ID
STL118262
SMILES O=C(Nc1ccc(cc1C)Cl)/C=C/c1ccc(cc1)C(C)(C)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 C20H22ClNO MW 327.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22ClNO/c1-14-13-17(21)10-11-18(14)22-19(23)12-7-15-5-8-16(9-6-15)20(2,3)4/h5-13H,1-4H3,(H,22,23)/b12-7+InChIKey
VQPBPMJXVJEKHM-KPKJPENVSA-NSynonyms
(2E)3(4tertbutylphenyl)N(4chloro2methylphenyl)prop2enamide
(E)3(4TERTBUTYLPHENYL)N(4CHLORO2METHYLPHENYL)PROP2ENAMIDE
CC1=C(C=CC(=C1)Cl)NC(=O)C=CC2=CC=C(C=C2)C(C)(C)C
InChI=1SC20H22ClNOc1141317(21)101118(14)2219(23)127155816(9615)20(23)4h513H14H3(H2223)b127+
MFCD03252272
O=C(Nc1ccc(cc1C)Cl)C=Cc1ccc(cc1)C(C)(C)C
ZINC000002817122
ZINC02817122
ZINC2817122
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