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

Systemtic Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-(2-methyl-5-nitro-phenyl)propanamide Openeye Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-(2-methyl-5-nitro-phenyl)propanamide CAS Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]-N-(2-methyl-5-nitrophenyl)propanamide IUPAC Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-(2-methyl-5-nitrophenyl)propanamide Traditional Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]-N-(2-methyl-5-nitro-phenyl)propionamide Formula: C25H21N5O3S MolecularWeight: 471.53094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C(C)SC2=NC(=C(N=N2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C(C)SC2=NC(=C(N=N2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H21N5O3S/c1-16-13-14-20(30(32)33)15-21(16)26-24(31)17(2)34-25-27-22(18-9-5-3-6-10-18)23(28-29-25)19-11-7-4-8-12-19/h3-15,17H,1-2H3,(H,26,31)