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

Systemtic Name: (2S)-N-ethyl-2-[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-propanamide Openeye Name: (2S)-N-ethyl-2-[[4-ethyl-5-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-propanamide CAS Name: (2S)-N-ethyl-2-[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]-N-phenylpropanamide IUPAC Name: (2S)-N-ethyl-2-[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylpropanamide Traditional Name: (2S)-N-ethyl-2-[[4-ethyl-5-(o-tolyl)-1,2,4-triazol-3-yl]thio]-N-phenyl-propionamide Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC(C)C(=O)N(CC)C2=CC=CC=C2)C3=CC=CC=C3C

Isomeric SMILES

CCN1C(=NN=C1S[C@@H](C)C(=O)N(CC)C2=CC=CC=C2)C3=CC=CC=C3C

InChI

InChI=1S/C22H26N4OS/c1-5-25(18-13-8-7-9-14-18)21(27)17(4)28-22-24-23-20(26(22)6-2)19-15-11-10-12-16(19)3/h7-15,17H,5-6H2,1-4H3/t17-/m0/s1