1-(3-methylphenyl)-3-[(Z)-N-(4-methylphenyl)sulfonyl-C-phenyl-carbonimidoyl]thiourea

Systemtic Name: 1-(3-methylphenyl)-3-[(Z)-N-(4-methylphenyl)sulfonyl-C-phenyl-carbonimidoyl]thiourea Openeye Name: 1-(m-tolyl)-3-[(Z)-C-phenyl-N-(p-tolylsulfonyl)carbonimidoyl]thiourea CAS Name: 1-(3-methylphenyl)-3-[(Z)-(4-methylphenyl)sulfonylimino-phenylmethyl]thiourea IUPAC Name: 1-(3-methylphenyl)-3-[(Z)-N-(4-methylphenyl)sulfonyl-C-phenylcarbonimidoyl]thiourea Traditional Name: 1-(m-tolyl)-3-[(Z)-C-phenyl-N-tosyl-carbonimidoyl]thiourea Formula: C22H21N3O2S2 MolecularWeight: 423.55104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N=C(C2=CC=CC=C2)NC(=S)NC3=CC=CC(=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/N=C(/C2=CC=CC=C2)\NC(=S)NC3=CC=CC(=C3)C

InChI

InChI=1S/C22H21N3O2S2/c1-16-11-13-20(14-12-16)29(26,27)25-21(18-8-4-3-5-9-18)24-22(28)23-19-10-6-7-17(2)15-19/h3-15H,1-2H3,(H2,23,24,25,28)