O-[4-(naphthalen-1-ylcarbamoyl)phenyl] N-(2-methylpropyl)carbamothioate

Systemtic Name: O-[4-(naphthalen-1-ylcarbamoyl)phenyl] N-(2-methylpropyl)carbamothioate Openeye Name: O-[4-(1-naphthylcarbamoyl)phenyl] N-isobutylcarbamothioate CAS Name: N-(2-methylpropyl)carbamothioic acid O-[4-[(1-naphthalenylamino)-oxomethyl]phenyl] ester IUPAC Name: O-[4-(naphthalen-1-ylcarbamoyl)phenyl] N-(2-methylpropyl)carbamothioate Traditional Name: N-isobutylthiocarbamic acid O-[4-(1-naphthylcarbamoyl)phenyl] ester Formula: C22H22N2O2S MolecularWeight: 378.48728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=S)OC1=CC=C(C=C1)C(=O)NC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC(C)CNC(=S)OC1=CC=C(C=C1)C(=O)NC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C22H22N2O2S/c1-15(2)14-23-22(27)26-18-12-10-17(11-13-18)21(25)24-20-9-5-7-16-6-3-4-8-19(16)20/h3-13,15H,14H2,1-2H3,(H,23,27)(H,24,25)