N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[(1-morpholinocyclohexyl)methyl]-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[[1-(4-morpholinyl)cyclohexyl]methyl]-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-[(1-morpholinocyclohexyl)methyl]-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C21H29N5O2S MolecularWeight: 415.55226

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)CSC2=NN=CN2C3=CC=CC=C3)N4CCOCC4

Isomeric SMILES

C1CCC(CC1)(CNC(=O)CSC2=NN=CN2C3=CC=CC=C3)N4CCOCC4

InChI

InChI=1S/C21H29N5O2S/c27-19(15-29-20-24-23-17-26(20)18-7-3-1-4-8-18)22-16-21(9-5-2-6-10-21)25-11-13-28-14-12-25/h1,3-4,7-8,17H,2,5-6,9-16H2,(H,22,27)