N-(2-methylcyclohexyl)-2-[[4-(2-methylpropyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(2-methylcyclohexyl)-2-[[4-(2-methylpropyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-isobutyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylcyclohexyl)acetamide CAS Name: N-(2-methylcyclohexyl)-2-[[4-(2-methylpropyl)-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(2-methylcyclohexyl)-2-[[4-(2-methylpropyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[4-isobutyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-N-(2-methylcyclohexyl)acetamide Formula: C20H29N5OS MolecularWeight: 387.54216

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)CSC2=NN=C(N2CC(C)C)C3=CN=CC=C3

Isomeric SMILES

CC1CCCCC1NC(=O)CSC2=NN=C(N2CC(C)C)C3=CN=CC=C3

InChI

InChI=1S/C20H29N5OS/c1-14(2)12-25-19(16-8-6-10-21-11-16)23-24-20(25)27-13-18(26)22-17-9-5-4-7-15(17)3/h6,8,10-11,14-15,17H,4-5,7,9,12-13H2,1-3H3,(H,22,26)