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

Systemtic Name: N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: 2-[[4-allyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(1-morpholinocyclohexyl)methyl]acetamide CAS Name: N-[[1-(4-morpholinyl)cyclohexyl]methyl]-2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[[4-allyl-5-(4-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:

C=CCN1C(=NN=C1SCC(=O)NCC2(CCCCC2)N3CCOCC3)C4=CC=NC=C4

Isomeric SMILES

C=CCN1C(=NN=C1SCC(=O)NCC2(CCCCC2)N3CCOCC3)C4=CC=NC=C4

InChI

InChI=1S/C23H32N6O2S/c1-2-12-29-21(19-6-10-24-11-7-19)26-27-22(29)32-17-20(30)25-18-23(8-4-3-5-9-23)28-13-15-31-16-14-28/h2,6-7,10-11H,1,3-5,8-9,12-18H2,(H,25,30)