Vitas-M small molecule compound
2-{[5-(1-benzofuran-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,5-dimethylphenyl)acetamide
Catalog ID
STL364220
SMILES C=CCn1c(SCC(=O)Nc2cc(C)ccc2C)nnc1c1cc2c(o1)cccc2
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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 C23H22N4O2S MW 418.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O2S/c1-4-11-27-22(20-13-17-7-5-6-8-19(17)29-20)25-26-23(27)30-14-21(28)24-18-12-15(2)9-10-16(18)3/h4-10,12-13H,1,11,14H2,2-3H3,(H,24,28)InChIKey
JFPCZVUWRWOCPZ-UHFFFAOYSA-NSynonyms
2((5(1benzofuran2yl)4(prop2en1yl)4H124triazol3yl)sulfanyl)N(25dimethylphenyl)acetamide
2((5(1benzofuran2yl)4prop2enyl124triazol3yl)sulfanyl)N(25dimethylphenyl)acetamide
CC1=CC(=C(C=C1)C)NC(=O)CSC2=NN=C(N2CC=C)C3=CC4=CC=CC=C4O3
InChI=1SC23H22N4O2Sc14112722(201317756819(17)2920)252623(27)301421(28)24181215(2)91016(18)3h4101213H11114H223H3(H2428)
MFCD04405191
ZINC000006473110
ZINC06473110
ZINC6473110
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