1-methyl-3-[C-(4-methylphenyl)-N-[(4-nitrophenyl)methyl]carbonimidoyl]-1-phenyl-thiourea

Systemtic Name: 1-methyl-3-[C-(4-methylphenyl)-N-[(4-nitrophenyl)methyl]carbonimidoyl]-1-phenyl-thiourea Openeye Name: 1-methyl-3-[N-[(4-nitrophenyl)methyl]-C-(p-tolyl)carbonimidoyl]-1-phenyl-thiourea CAS Name: 1-methyl-3-[(4-methylphenyl)-[(4-nitrophenyl)methylimino]methyl]-1-phenylthiourea IUPAC Name: 1-methyl-3-[C-(4-methylphenyl)-N-[(4-nitrophenyl)methyl]carbonimidoyl]-1-phenylthiourea Traditional Name: 1-methyl-3-[N-(4-nitrobenzyl)-C-(p-tolyl)carbonimidoyl]-1-phenyl-thiourea Formula: C23H22N4O2S MolecularWeight: 418.51138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=NCC2=CC=C(C=C2)[N+](=O)[O-])NC(=S)N(C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(=NCC2=CC=C(C=C2)[N+](=O)[O-])NC(=S)N(C)C3=CC=CC=C3

InChI

InChI=1S/C23H22N4O2S/c1-17-8-12-19(13-9-17)22(24-16-18-10-14-21(15-11-18)27(28)29)25-23(30)26(2)20-6-4-3-5-7-20/h3-15H,16H2,1-2H3,(H,24,25,30)