Vitas-M small molecule compound
(2E)-N-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]-3-phenylprop-2-enamide
Catalog ID
STK016306
SMILES S=C(Nc1c(C)cc(cc1C)Br)NC(=O)/C=C/c1ccccc1
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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 C18H17BrN2OS MW 389.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17BrN2OS/c1-12-10-15(19)11-13(2)17(12)21-18(23)20-16(22)9-8-14-6-4-3-5-7-14/h3-11H,1-2H3,(H2,20,21,22,23)/b9-8+InChIKey
HYMMDBPGLKUSKQ-CMDGGOBGSA-NSynonyms
(2E)N((4BROMO26DIMETHYLPHENYL)CARBAMOTHIOYL)3PHENYLPROP2ENAMIDE
(E)N((4BROMO26DIMETHYLPHENYL)CARBAMOTHIOYL)3PHENYLPROP2ENAMIDE
CC1=CC(=CC(=C1NC(=S)NC(=O)C=CC2=CC=CC=C2)C)Br
InChI=1SC18H17BrN2OSc1121015(19)1113(2)17(12)2118(23)2016(22)98146435714h311H12H3(H220212223)b98+
MFCD02922691
S=C(Nc1c(C)cc(cc1C)Br)NC(=O)C=Cc1ccccc1
STK016306
ZINC000001179893
ZINC01179893
ZINC1179893
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