Vitas-M small molecule compound
N-cyclohexyl-2-{[4-ethyl-5-(4-methoxybenzyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-methylacetamide
Catalog ID
STL140357
SMILES COc1ccc(cc1)Cc1nnc(n1CC)SCC(=O)N(C1CCCCC1)C
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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 C21H30N4O2S MW 402.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H30N4O2S/c1-4-25-19(14-16-10-12-18(27-3)13-11-16)22-23-21(25)28-15-20(26)24(2)17-8-6-5-7-9-17/h10-13,17H,4-9,14-15H2,1-3H3InChIKey
DVWKSWAAHYRDMI-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)N(C)C2CCCCC2)CC3=CC=C(C=C3)OC
InChI=1SC21H30N4O2Sc142519(1416101218(273)131116)222321(25)281520(26)24(2)178657917h101317H491415H213H3
MFCD17011654
Ncyclohexyl2((4ethyl5((4methoxyphenyl)methyl)124triazol3yl)sulfanyl)Nmethylacetamide
Ncyclohexyl2((4ethyl5(4methoxybenzyl)4H124triazol3yl)sulfanyl)Nmethylacetamide
ZINC000048513815
ZINC48513815
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