(2S)-N-cyclohexyl-N-ethyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: (2S)-N-cyclohexyl-N-ethyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: (2S)-N-cyclohexyl-N-ethyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: (2S)-N-cyclohexyl-N-ethyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: (2S)-N-cyclohexyl-N-ethyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: (2S)-N-cyclohexyl-N-ethyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]propionamide Formula: C19H26N4OS MolecularWeight: 358.50094

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCCCC1)C(=O)C(C)SC2=NNC(=N2)C3=CC=CC=C3

Isomeric SMILES

CCN(C1CCCCC1)C(=O)[C@H](C)SC2=NNC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C19H26N4OS/c1-3-23(16-12-8-5-9-13-16)18(24)14(2)25-19-20-17(21-22-19)15-10-6-4-7-11-15/h4,6-7,10-11,14,16H,3,5,8-9,12-13H2,1-2H3,(H,20,21,22)/t14-/m0/s1