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

Systemtic Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-morpholin-4-ylphenyl)ethanamide Openeye Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-morpholinophenyl)acetamide CAS Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-[3-(4-morpholinyl)phenyl]acetamide IUPAC Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-morpholin-4-ylphenyl)acetamide Traditional Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-(3-morpholinophenyl)acetamide Formula: C21H29N5O2S MolecularWeight: 415.55226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2CCCCC2)SCC(=O)NC3=CC=CC(=C3)N4CCOCC4

Isomeric SMILES

CC1=NN=C(N1C2CCCCC2)SCC(=O)NC3=CC=CC(=C3)N4CCOCC4

InChI

InChI=1S/C21H29N5O2S/c1-16-23-24-21(26(16)18-7-3-2-4-8-18)29-15-20(27)22-17-6-5-9-19(14-17)25-10-12-28-13-11-25/h5-6,9,14,18H,2-4,7-8,10-13,15H2,1H3,(H,22,27)