2-[2-[(5-cyclohexyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl-methyl-amino]-N-methyl-ethanamide

Systemtic Name: 2-[2-[(5-cyclohexyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl-methyl-amino]-N-methyl-ethanamide Openeye Name: 2-[[2-[(5-cyclohexyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-methyl-amino]-N-methyl-acetamide CAS Name: 2-[[2-[(5-cyclohexyl-1-phenyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]-methylamino]-N-methylacetamide IUPAC Name: 2-[[2-[(5-cyclohexyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-methylamino]-N-methylacetamide Traditional Name: 2-[[2-[(5-cyclohexyl-1-phenyl-1,2,4-triazol-3-yl)thio]acetyl]-methyl-amino]-N-methyl-acetamide Formula: C20H27N5O2S MolecularWeight: 401.52568

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CN(C)C(=O)CSC1=NN(C(=N1)C2CCCCC2)C3=CC=CC=C3

Isomeric SMILES

CNC(=O)CN(C)C(=O)CSC1=NN(C(=N1)C2CCCCC2)C3=CC=CC=C3

InChI

InChI=1S/C20H27N5O2S/c1-21-17(26)13-24(2)18(27)14-28-20-22-19(15-9-5-3-6-10-15)25(23-20)16-11-7-4-8-12-16/h4,7-8,11-12,15H,3,5-6,9-10,13-14H2,1-2H3,(H,21,26)