O-[4-[(2,3-dimethylphenyl)carbamoyl]phenyl] piperidine-1-carbothioate

Systemtic Name: O-[4-[(2,3-dimethylphenyl)carbamoyl]phenyl] piperidine-1-carbothioate Openeye Name: O-[4-[(2,3-dimethylphenyl)carbamoyl]phenyl] piperidine-1-carbothioate CAS Name: 1-piperidinecarbothioic acid O-[4-[(2,3-dimethylanilino)-oxomethyl]phenyl] ester IUPAC Name: O-[4-[(2,3-dimethylphenyl)carbamoyl]phenyl] piperidine-1-carbothioate Traditional Name: piperidine-1-carbothioic acid O-[4-[(2,3-dimethylphenyl)carbamoyl]phenyl] ester Formula: C21H24N2O2S MolecularWeight: 368.49246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C2=CC=C(C=C2)OC(=S)N3CCCCC3)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)C2=CC=C(C=C2)OC(=S)N3CCCCC3)C

InChI

InChI=1S/C21H24N2O2S/c1-15-7-6-8-19(16(15)2)22-20(24)17-9-11-18(12-10-17)25-21(26)23-13-4-3-5-14-23/h6-12H,3-5,13-14H2,1-2H3,(H,22,24)