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

Systemtic Name: (2S)-N-cyclohexyl-N-ethyl-2-[[4-methyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: (2S)-N-cyclohexyl-N-ethyl-2-[[4-methyl-5-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: (2S)-N-cyclohexyl-N-ethyl-2-[[4-methyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: (2S)-N-cyclohexyl-N-ethyl-2-[[4-methyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: (2S)-N-cyclohexyl-N-ethyl-2-[[4-methyl-5-(o-tolyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C21H30N4OS MolecularWeight: 386.5541

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCCCC1)C(=O)C(C)SC2=NN=C(N2C)C3=CC=CC=C3C

Isomeric SMILES

CCN(C1CCCCC1)C(=O)[C@H](C)SC2=NN=C(N2C)C3=CC=CC=C3C

InChI

InChI=1S/C21H30N4OS/c1-5-25(17-12-7-6-8-13-17)20(26)16(3)27-21-23-22-19(24(21)4)18-14-10-9-11-15(18)2/h9-11,14,16-17H,5-8,12-13H2,1-4H3/t16-/m0/s1