O-[3-[(3,4-dimethylphenyl)carbamoyl]phenyl] N-(2-methylphenyl)carbamothioate

Systemtic Name: O-[3-[(3,4-dimethylphenyl)carbamoyl]phenyl] N-(2-methylphenyl)carbamothioate Openeye Name: O-[3-[(3,4-dimethylphenyl)carbamoyl]phenyl] N-(o-tolyl)carbamothioate CAS Name: N-(2-methylphenyl)carbamothioic acid O-[3-[(3,4-dimethylanilino)-oxomethyl]phenyl] ester IUPAC Name: O-[3-[(3,4-dimethylphenyl)carbamoyl]phenyl] N-(2-methylphenyl)carbamothioate Traditional Name: N-(o-tolyl)thiocarbamic acid O-[3-[(3,4-dimethylphenyl)carbamoyl]phenyl] ester Formula: C23H22N2O2S MolecularWeight: 390.49798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)OC(=S)NC3=CC=CC=C3C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)OC(=S)NC3=CC=CC=C3C)C

InChI

InChI=1S/C23H22N2O2S/c1-15-11-12-19(13-17(15)3)24-22(26)18-8-6-9-20(14-18)27-23(28)25-21-10-5-4-7-16(21)2/h4-14H,1-3H3,(H,24,26)(H,25,28)