Vitas-M small molecule compound
2-[3-(4-chlorophenyl)-4-(1H-pyrrol-1-yl)-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-N-cyclohexylacetamide
Catalog ID
STL274230
SMILES O=C(Cn1nc(n(c1=S)n1cccc1)c1ccc(cc1)Cl)NC1CCCCC1
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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 C20H22ClN5OS MW 415.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22ClN5OS/c21-16-10-8-15(9-11-16)19-23-25(20(28)26(19)24-12-4-5-13-24)14-18(27)22-17-6-2-1-3-7-17/h4-5,8-13,17H,1-3,6-7,14H2,(H,22,27)InChIKey
LAHDDQFXYHVMDX-UHFFFAOYSA-NSynonyms
2(3(4chlorophenyl)4(1Hpyrrol1yl)5thioxo45dihydro1H124triazol1yl)Ncyclohexylacetamide
2(3(4chlorophenyl)4pyrrol1yl5sulfanylidene124triazol1yl)Ncyclohexylacetamide
2(3(4CHLOROPHENYL)4PYRROLYL5THIOXO(124TRIAZOLINYL))NCYCLOHEXYLACETAMIDE
C1CCC(CC1)NC(=O)CN2C(=S)N(C(=N2)C3=CC=C(C=C3)Cl)N4C=CC=C4
InChI=1SC20H22ClN5OSc211610815(91116)192325(20(28)26(19)2412451324)1418(27)22176213717h4581317H136714H2(H2227)
MFCD07423312
ZINC000016778165
ZINC16778165
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