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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)OC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)I

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)OC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)I

InChI

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