Vitas-M small molecule compound
(2E)-N-[(6-methyl-2-phenyl-2H-benzotriazol-5-yl)carbamothioyl]-3-phenylprop-2-enamide
Catalog ID
STK026008
SMILES O=C(NC(=S)Nc1cc2nn(nc2cc1C)c1ccccc1)/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 C23H19N5OS MW 413.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N5OS/c1-16-14-20-21(27-28(26-20)18-10-6-3-7-11-18)15-19(16)24-23(30)25-22(29)13-12-17-8-4-2-5-9-17/h2-15H,1H3,(H2,24,25,29,30)/b13-12+InChIKey
IERQHFNEERSJEM-OUKQBFOZSA-NSynonyms
(2E)N((6METHYL2PHENYL2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)3PHENYLPROP2ENAMIDE
(E)N((6METHYL2PHENYLBENZOTRIAZOL5YL)CARBAMOTHIOYL)3PHENYLPROP2ENAMIDE
CC1=CC2=NN(N=C2C=C1NC(=S)NC(=O)C=CC3=CC=CC=C3)C4=CC=CC=C4
InChI=1SC23H19N5OSc116142021(2728(2620)18106371118)1519(16)2423(30)2522(29)1312178425917h215H1H3(H224252930)b1312+
MFCD03030606
O=C(NC(=S)Nc1cc2nn(nc2cc1C)c1ccccc1)C=Cc1ccccc1
STK026008
ZINC000001181764
ZINC01181764
ZINC1181764
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