2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-[(2S)-3-methylbutan-2-yl]ethanamide

Systemtic Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-[(2S)-3-methylbutan-2-yl]ethanamide Openeye Name: N-[(1S)-1,2-dimethylpropyl]-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]acetamide CAS Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]-N-[(2S)-3-methylbutan-2-yl]acetamide IUPAC Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-[(2S)-3-methylbutan-2-yl]acetamide Traditional Name: N-[(1S)-1,2-dimethylpropyl]-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]acetamide Formula: C22H24N4OS MolecularWeight: 392.51716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)NC(=O)CSC1=NC(=C(N=N1)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(C)C)NC(=O)CSC1=NC(=C(N=N1)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H24N4OS/c1-15(2)16(3)23-19(27)14-28-22-24-20(17-10-6-4-7-11-17)21(25-26-22)18-12-8-5-9-13-18/h4-13,15-16H,14H2,1-3H3,(H,23,27)/t16-/m0/s1