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

Systemtic Name: 2-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[(1-morpholin-4-ylcyclohexyl)methyl]ethanamide Openeye Name: 2-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[(1-morpholinocyclohexyl)methyl]acetamide CAS Name: 2-[[4-cyclopropyl-5-(1-pyrrolidinyl)-1,2,4-triazol-3-yl]thio]-N-[[1-(4-morpholinyl)cyclohexyl]methyl]acetamide IUPAC Name: 2-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide Traditional Name: 2-[(4-cyclopropyl-5-pyrrolidino-1,2,4-triazol-3-yl)thio]-N-[(1-morpholinocyclohexyl)methyl]acetamide Formula: C22H36N6O2S MolecularWeight: 448.62524

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)CSC2=NN=C(N2C3CC3)N4CCCC4)N5CCOCC5

Isomeric SMILES

C1CCC(CC1)(CNC(=O)CSC2=NN=C(N2C3CC3)N4CCCC4)N5CCOCC5

InChI

InChI=1S/C22H36N6O2S/c29-19(23-17-22(8-2-1-3-9-22)27-12-14-30-15-13-27)16-31-21-25-24-20(26-10-4-5-11-26)28(21)18-6-7-18/h18H,1-17H2,(H,23,29)