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

Systemtic Name: O-[4-[(2-fluorophenyl)carbamoyl]phenyl] N,N-bis(2-methylpropyl)carbamothioate Openeye Name: O-[4-[(2-fluorophenyl)carbamoyl]phenyl] N,N-diisobutylcarbamothioate CAS Name: N,N-bis(2-methylpropyl)carbamothioic acid O-[4-[(2-fluoroanilino)-oxomethyl]phenyl] ester IUPAC Name: O-[4-[(2-fluorophenyl)carbamoyl]phenyl] N,N-bis(2-methylpropyl)carbamothioate Traditional Name: N,N-diisobutylthiocarbamic acid O-[4-[(2-fluorophenyl)carbamoyl]phenyl] ester Formula: C22H27FN2O2S MolecularWeight: 402.525383

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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=CC=C2F

Isomeric SMILES

CC(C)CN(CC(C)C)C(=S)OC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2F

InChI

InChI=1S/C22H27FN2O2S/c1-15(2)13-25(14-16(3)4)22(28)27-18-11-9-17(10-12-18)21(26)24-20-8-6-5-7-19(20)23/h5-12,15-16H,13-14H2,1-4H3,(H,24,26)