N-butyl-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]butanamide

Systemtic Name: N-butyl-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]butanamide Openeye Name: N-butyl-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]butanamide CAS Name: N-butyl-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]butanamide IUPAC Name: N-butyl-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]butanamide Traditional Name: N-butyl-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]butyramide Formula: C23H26N4OS MolecularWeight: 406.54374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(CC)SC1=NC(=C(N=N1)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCNC(=O)C(CC)SC1=NC(=C(N=N1)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H26N4OS/c1-3-5-16-24-22(28)19(4-2)29-23-25-20(17-12-8-6-9-13-17)21(26-27-23)18-14-10-7-11-15-18/h6-15,19H,3-5,16H2,1-2H3,(H,24,28)