O-[3-[(2-chlorophenyl)carbamoyl]phenyl] N-(4-iodophenyl)carbamothioate

Systemtic Name: O-[3-[(2-chlorophenyl)carbamoyl]phenyl] N-(4-iodophenyl)carbamothioate Openeye Name: O-[3-[(2-chlorophenyl)carbamoyl]phenyl] N-(4-iodophenyl)carbamothioate CAS Name: N-(4-iodophenyl)carbamothioic acid O-[3-[(2-chloroanilino)-oxomethyl]phenyl] ester IUPAC Name: O-[3-[(2-chlorophenyl)carbamoyl]phenyl] N-(4-iodophenyl)carbamothioate Traditional Name: N-(4-iodophenyl)thiocarbamic acid O-[3-[(2-chlorophenyl)carbamoyl]phenyl] ester Formula: C20H14ClIN2O2S MolecularWeight: 508.75983

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H14ClIN2O2S/c21-17-6-1-2-7-18(17)24-19(25)13-4-3-5-16(12-13)26-20(27)23-15-10-8-14(22)9-11-15/h1-12H,(H,23,27)(H,24,25)