Vitas-M small molecule compound
(2E)-3-(furan-2-yl)-N-{[6-methyl-2-(4-methylphenyl)-2H-benzotriazol-5-yl]carbamothioyl}prop-2-enamide
Catalog ID
STK184530
SMILES S=C(Nc1cc2nn(nc2cc1C)c1ccc(cc1)C)NC(=O)/C=C/c1ccco1
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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 C22H19N5O2S MW 417.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N5O2S/c1-14-5-7-16(8-6-14)27-25-19-12-15(2)18(13-20(19)26-27)23-22(30)24-21(28)10-9-17-4-3-11-29-17/h3-13H,1-2H3,(H2,23,24,28,30)/b10-9+InChIKey
RSWUPGBHTNDRTC-MDZDMXLPSA-NSynonyms
(2E)3(FURAN2YL)N((6METHYL2(4METHYLPHENYL)2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)PROP2ENAMIDE
(E)3(FURAN2YL)N((6METHYL2(4METHYLPHENYL)BENZOTRIAZOL5YL)CARBAMOTHIOYL)PROP2ENAMIDE
3(2FURYL)N(((6METHYL2(4METHYLPHENYL)2H123BENZOTRIAZOL5YL)AMINO)CARBONOTHIOYL)ACRYLAMIDE
CC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=S)NC(=O)C=CC4=CC=CO4)C
InChI=1SC22H19N5O2Sc1145716(8614)2725191215(2)18(1320(19)2627)2322(30)2421(28)1091743112917h313H12H3(H223242830)b109+
MFCD03137808
S=C(Nc1cc2nn(nc2cc1C)c1ccc(cc1)C)NC(=O)C=Cc1ccco1
ZINC000001179713
ZINC01179713
ZINC1179713
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