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

Systemtic Name: O-[4-[(4-iodophenyl)carbamoyl]phenyl] N-methyl-N-phenyl-carbamothioate Openeye Name: O-[4-[(4-iodophenyl)carbamoyl]phenyl] N-methyl-N-phenyl-carbamothioate CAS Name: N-methyl-N-phenylcarbamothioic acid O-[4-[(4-iodoanilino)-oxomethyl]phenyl] ester IUPAC Name: O-[4-[(4-iodophenyl)carbamoyl]phenyl] N-methyl-N-phenylcarbamothioate Traditional Name: N-methyl-N-phenyl-thiocarbamic acid O-[4-[(4-iodophenyl)carbamoyl]phenyl] ester Formula: C21H17IN2O2S MolecularWeight: 488.34135

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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