2-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[(1-morpholin-4-ylcyclohexyl)methyl]ethanamide

Systemtic Name: 2-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[(1-morpholin-4-ylcyclohexyl)methyl]ethanamide Openeye Name: 2-[[4-cyclopropyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(1-morpholinocyclohexyl)methyl]acetamide CAS Name: 2-[[4-cyclopropyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-N-[[1-(4-morpholinyl)cyclohexyl]methyl]acetamide IUPAC Name: 2-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide Traditional Name: 2-[[4-cyclopropyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-N-[(1-morpholinocyclohexyl)methyl]acetamide Formula: C23H32N6O2S MolecularWeight: 456.60418

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)CSC2=NN=C(N2C3CC3)C4=CN=CC=C4)N5CCOCC5

Isomeric SMILES

C1CCC(CC1)(CNC(=O)CSC2=NN=C(N2C3CC3)C4=CN=CC=C4)N5CCOCC5

InChI

InChI=1S/C23H32N6O2S/c30-20(25-17-23(8-2-1-3-9-23)28-11-13-31-14-12-28)16-32-22-27-26-21(29(22)19-6-7-19)18-5-4-10-24-15-18/h4-5,10,15,19H,1-3,6-9,11-14,16-17H2,(H,25,30)