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

Systemtic Name: O-[4-[(4-iodophenyl)carbamoyl]phenyl] N-(4-ethoxyphenyl)carbamothioate Openeye Name: O-[4-[(4-iodophenyl)carbamoyl]phenyl] N-(4-ethoxyphenyl)carbamothioate CAS Name: N-(4-ethoxyphenyl)carbamothioic acid O-[4-[(4-iodoanilino)-oxomethyl]phenyl] ester IUPAC Name: O-[4-[(4-iodophenyl)carbamoyl]phenyl] N-(4-ethoxyphenyl)carbamothioate Traditional Name: N-p-phenetylthiocarbamic acid O-[4-[(4-iodophenyl)carbamoyl]phenyl] ester Formula: C22H19IN2O3S MolecularWeight: 518.36733

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)OC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)I

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)OC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)I

InChI

InChI=1S/C22H19IN2O3S/c1-2-27-19-13-9-18(10-14-19)25-22(29)28-20-11-3-15(4-12-20)21(26)24-17-7-5-16(23)6-8-17/h3-14H,2H2,1H3,(H,24,26)(H,25,29)