2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2S)-6-methylheptan-2-yl]ethanamide

Systemtic Name: 2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2S)-6-methylheptan-2-yl]ethanamide Openeye Name: N-[(1S)-1,5-dimethylhexyl]-2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: 2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]-N-[(2S)-6-methylheptan-2-yl]acetamide IUPAC Name: 2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2S)-6-methylheptan-2-yl]acetamide Traditional Name: N-[(1S)-1,5-dimethylhexyl]-2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C20H30N4OS MolecularWeight: 374.5434

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC(C)CCCC(C)C)C2=CC=CC=C2

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)N[C@@H](C)CCCC(C)C)C2=CC=CC=C2

InChI

InChI=1S/C20H30N4OS/c1-5-24-19(17-12-7-6-8-13-17)22-23-20(24)26-14-18(25)21-16(4)11-9-10-15(2)3/h6-8,12-13,15-16H,5,9-11,14H2,1-4H3,(H,21,25)/t16-/m0/s1