Vitas-M small molecule compound
(2E)-3-[5-(3-chloro-4-methylphenyl)furan-2-yl]-N-[(2,6-dimethylphenyl)carbamothioyl]prop-2-enamide
Catalog ID
STK294630
SMILES S=C(Nc1c(C)cccc1C)NC(=O)/C=C/c1ccc(o1)c1ccc(c(c1)Cl)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 C23H21ClN2O2S MW 424.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21ClN2O2S/c1-14-7-8-17(13-19(14)24)20-11-9-18(28-20)10-12-21(27)25-23(29)26-22-15(2)5-4-6-16(22)3/h4-13H,1-3H3,(H2,25,26,27,29)/b12-10+InChIKey
XRKQUAJGLDALQC-ZRDIBKRKSA-NSynonyms
(2E)3(5(3chloro4methylphenyl)furan2yl)N((26dimethylphenyl)carbamothioyl)prop2enamide
(E)3(5(3chloro4methylphenyl)furan2yl)N((26dimethylphenyl)carbamothioyl)prop2enamide
CC1=C(C(=CC=C1)C)NC(=S)NC(=O)C=CC2=CC=C(O2)C3=CC(=C(C=C3)C)Cl
InChI=1SC23H21ClN2O2Sc1147817(1319(14)24)2011918(2820)101221(27)2523(29)262215(2)54616(22)3h413H13H3(H225262729)b1210+
MFCD07606823
S=C(Nc1c(C)cccc1C)NC(=O)C=Cc1ccc(o1)c1ccc(c(c1)Cl)C
ZINC000013946141
ZINC13946141
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