N-(5-chloranyl-2-methyl-phenyl)-3-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]propanamide

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-3-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]propanamide Openeye Name: N-(5-chloro-2-methyl-phenyl)-3-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]propanamide CAS Name: N-(5-chloro-2-methylphenyl)-3-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]propanamide IUPAC Name: N-(5-chloro-2-methylphenyl)-3-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]propanamide Traditional Name: N-(5-chloro-2-methyl-phenyl)-3-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]propionamide Formula: C25H21ClN4OS MolecularWeight: 460.97844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=O)CCSC2=NC(=C(N=N2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=O)CCSC2=NC(=C(N=N2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H21ClN4OS/c1-17-12-13-20(26)16-21(17)27-22(31)14-15-32-25-28-23(18-8-4-2-5-9-18)24(29-30-25)19-10-6-3-7-11-19/h2-13,16H,14-15H2,1H3,(H,27,31)