O-[4-[(4-chlorophenyl)carbamoyl]phenyl] N-(4-dimethylaminophenyl)carbamothioate

Systemtic Name: O-[4-[(4-chlorophenyl)carbamoyl]phenyl] N-(4-dimethylaminophenyl)carbamothioate Openeye Name: O-[4-[(4-chlorophenyl)carbamoyl]phenyl] N-(4-dimethylaminophenyl)carbamothioate CAS Name: N-(4-dimethylaminophenyl)carbamothioic acid O-[4-[(4-chloroanilino)-oxomethyl]phenyl] ester IUPAC Name: O-[4-[(4-chlorophenyl)carbamoyl]phenyl] N-(4-dimethylaminophenyl)carbamothioate Traditional Name: N-(4-dimethylaminophenyl)thiocarbamic acid O-[4-[(4-chlorophenyl)carbamoyl]phenyl] ester Formula: C22H20ClN3O2S MolecularWeight: 425.9311

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)NC(=S)OC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CN(C)C1=CC=C(C=C1)NC(=S)OC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H20ClN3O2S/c1-26(2)19-11-9-18(10-12-19)25-22(29)28-20-13-3-15(4-14-20)21(27)24-17-7-5-16(23)6-8-17/h3-14H,1-2H3,(H,24,27)(H,25,29)