1-(2-methylphenyl)-3-[4-[4-[(2-methylphenyl)carbamothioylamino]phenyl]sulfanylphenyl]thiourea

Systemtic Name: 1-(2-methylphenyl)-3-[4-[4-[(2-methylphenyl)carbamothioylamino]phenyl]sulfanylphenyl]thiourea Openeye Name: 1-(o-tolyl)-3-[4-[4-(o-tolylcarbamothioylamino)phenyl]sulfanylphenyl]thiourea CAS Name: 1-[4-[[4-[[(2-methylanilino)-sulfanylidenemethyl]amino]phenyl]thio]phenyl]-3-(2-methylphenyl)thiourea IUPAC Name: 1-(2-methylphenyl)-3-[4-[4-[(2-methylphenyl)carbamothioylamino]phenyl]sulfanylphenyl]thiourea Traditional Name: 1-(o-tolyl)-3-[4-[[4-(o-tolylthiocarbamoylamino)phenyl]thio]phenyl]thiourea Formula: C28H26N4S3 MolecularWeight: 514.72784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)NC2=CC=C(C=C2)SC3=CC=C(C=C3)NC(=S)NC4=CC=CC=C4C

Isomeric SMILES

CC1=CC=CC=C1NC(=S)NC2=CC=C(C=C2)SC3=CC=C(C=C3)NC(=S)NC4=CC=CC=C4C

InChI

InChI=1S/C28H26N4S3/c1-19-7-3-5-9-25(19)31-27(33)29-21-11-15-23(16-12-21)35-24-17-13-22(14-18-24)30-28(34)32-26-10-6-4-8-20(26)2/h3-18H,1-2H3,(H2,29,31,33)(H2,30,32,34)