O-[4-[(3-methylphenyl)carbamoyl]phenyl] piperidine-1-carbothioate

Systemtic Name: O-[4-[(3-methylphenyl)carbamoyl]phenyl] piperidine-1-carbothioate Openeye Name: O-[4-(m-tolylcarbamoyl)phenyl] piperidine-1-carbothioate CAS Name: 1-piperidinecarbothioic acid O-[4-[(3-methylanilino)-oxomethyl]phenyl] ester IUPAC Name: O-[4-[(3-methylphenyl)carbamoyl]phenyl] piperidine-1-carbothioate Traditional Name: piperidine-1-carbothioic acid O-[4-(m-tolylcarbamoyl)phenyl] ester Formula: C20H22N2O2S MolecularWeight: 354.46588

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O2S/c1-15-6-5-7-17(14-15)21-19(23)16-8-10-18(11-9-16)24-20(25)22-12-3-2-4-13-22/h5-11,14H,2-4,12-13H2,1H3,(H,21,23)