O-[4-[(2-methoxyphenyl)carbamoyl]phenyl] N-(4-iodophenyl)carbamothioate

Systemtic Name: O-[4-[(2-methoxyphenyl)carbamoyl]phenyl] N-(4-iodophenyl)carbamothioate Openeye Name: O-[4-[(2-methoxyphenyl)carbamoyl]phenyl] N-(4-iodophenyl)carbamothioate CAS Name: N-(4-iodophenyl)carbamothioic acid O-[4-[(2-methoxyanilino)-oxomethyl]phenyl] ester IUPAC Name: O-[4-[(2-methoxyphenyl)carbamoyl]phenyl] N-(4-iodophenyl)carbamothioate Traditional Name: N-(4-iodophenyl)thiocarbamic acid O-[4-[(2-methoxyphenyl)carbamoyl]phenyl] ester Formula: C21H17IN2O3S MolecularWeight: 504.34075

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)OC(=S)NC3=CC=C(C=C3)I

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)OC(=S)NC3=CC=C(C=C3)I

InChI

InChI=1S/C21H17IN2O3S/c1-26-19-5-3-2-4-18(19)24-20(25)14-6-12-17(13-7-14)27-21(28)23-16-10-8-15(22)9-11-16/h2-13H,1H3,(H,23,28)(H,24,25)