O-[4-[(3-methylphenyl)carbamoyl]phenyl] N-(4-iodophenyl)carbamothioate

Systemtic Name: O-[4-[(3-methylphenyl)carbamoyl]phenyl] N-(4-iodophenyl)carbamothioate Openeye Name: O-[4-(m-tolylcarbamoyl)phenyl] N-(4-iodophenyl)carbamothioate CAS Name: N-(4-iodophenyl)carbamothioic acid O-[4-[(3-methylanilino)-oxomethyl]phenyl] ester IUPAC Name: O-[4-[(3-methylphenyl)carbamoyl]phenyl] N-(4-iodophenyl)carbamothioate Traditional Name: N-(4-iodophenyl)thiocarbamic acid O-[4-(m-tolylcarbamoyl)phenyl] ester Formula: C21H17IN2O2S MolecularWeight: 488.34135

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17IN2O2S/c1-14-3-2-4-18(13-14)23-20(25)15-5-11-19(12-6-15)26-21(27)24-17-9-7-16(22)8-10-17/h2-13H,1H3,(H,23,25)(H,24,27)