1-[2-[carbamothioyl(phenyl)amino]-4,5-dimethyl-phenyl]-1-phenyl-thiourea

Systemtic Name: 1-[2-[carbamothioyl(phenyl)amino]-4,5-dimethyl-phenyl]-1-phenyl-thiourea Openeye Name: 1-[2-(N-carbamothioylanilino)-4,5-dimethyl-phenyl]-1-phenyl-thiourea CAS Name: 1-[2-(N-carbamothioylanilino)-4,5-dimethylphenyl]-1-phenylthiourea IUPAC Name: 1-[2-(N-carbamothioylanilino)-4,5-dimethylphenyl]-1-phenylthiourea Traditional Name: 1-[4,5-dimethyl-2-(N-thiocarbamoylanilino)phenyl]-1-phenyl-thiourea Formula: C22H22N4S2 MolecularWeight: 406.56688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)N(C2=CC=CC=C2)C(=S)N)N(C3=CC=CC=C3)C(=S)N

Isomeric SMILES

CC1=CC(=C(C=C1C)N(C2=CC=CC=C2)C(=S)N)N(C3=CC=CC=C3)C(=S)N

InChI

InChI=1S/C22H22N4S2/c1-15-13-19(25(21(23)27)17-9-5-3-6-10-17)20(14-16(15)2)26(22(24)28)18-11-7-4-8-12-18/h3-14H,1-2H3,(H2,23,27)(H2,24,28)