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

Systemtic Name: 2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(1-morpholin-4-ylcyclohexyl)methyl]ethanamide Openeye Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(1-morpholinocyclohexyl)methyl]acetamide CAS Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-N-[[1-(4-morpholinyl)cyclohexyl]methyl]acetamide IUPAC Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide Traditional Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-N-[(1-morpholinocyclohexyl)methyl]acetamide Formula: C21H36N6O2S MolecularWeight: 436.61454

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NN=C(N2N)SCC(=O)NCC3(CCCCC3)N4CCOCC4

Isomeric SMILES

C1CCC(CC1)C2=NN=C(N2N)SCC(=O)NCC3(CCCCC3)N4CCOCC4

InChI

InChI=1S/C21H36N6O2S/c22-27-19(17-7-3-1-4-8-17)24-25-20(27)30-15-18(28)23-16-21(9-5-2-6-10-21)26-11-13-29-14-12-26/h17H,1-16,22H2,(H,23,28)