O-[4-[(4-iodophenyl)carbamoyl]phenyl] N,N-bis(2-methylpropyl)carbamothioate

Systemtic Name: O-[4-[(4-iodophenyl)carbamoyl]phenyl] N,N-bis(2-methylpropyl)carbamothioate Openeye Name: O-[4-[(4-iodophenyl)carbamoyl]phenyl] N,N-diisobutylcarbamothioate CAS Name: N,N-bis(2-methylpropyl)carbamothioic acid O-[4-[(4-iodoanilino)-oxomethyl]phenyl] ester IUPAC Name: O-[4-[(4-iodophenyl)carbamoyl]phenyl] N,N-bis(2-methylpropyl)carbamothioate Traditional Name: N,N-diisobutylthiocarbamic acid O-[4-[(4-iodophenyl)carbamoyl]phenyl] ester Formula: C22H27IN2O2S MolecularWeight: 510.43145

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)C(=S)OC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)I

Isomeric SMILES

CC(C)CN(CC(C)C)C(=S)OC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)I

InChI

InChI=1S/C22H27IN2O2S/c1-15(2)13-25(14-16(3)4)22(28)27-20-11-5-17(6-12-20)21(26)24-19-9-7-18(23)8-10-19/h5-12,15-16H,13-14H2,1-4H3,(H,24,26)