O-(4-methylphenyl) 4-[[4-(dimethylaminomethyl)phenyl]methyl]piperidine-1-carbothioate

Systemtic Name: O-(4-methylphenyl) 4-[[4-(dimethylaminomethyl)phenyl]methyl]piperidine-1-carbothioate Openeye Name: O-(p-tolyl) 4-[[4-(dimethylaminomethyl)phenyl]methyl]piperidine-1-carbothioate CAS Name: 4-[[4-(dimethylaminomethyl)phenyl]methyl]-1-piperidinecarbothioic acid O-(4-methylphenyl) ester IUPAC Name: O-(4-methylphenyl) 4-[[4-(dimethylaminomethyl)phenyl]methyl]piperidine-1-carbothioate Traditional Name: 4-[4-(dimethylaminomethyl)benzyl]piperidine-1-carbothioic acid O-(p-tolyl) ester Formula: C23H30N2OS MolecularWeight: 382.5621

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC(=S)N2CCC(CC2)CC3=CC=C(C=C3)CN(C)C

Isomeric SMILES

CC1=CC=C(C=C1)OC(=S)N2CCC(CC2)CC3=CC=C(C=C3)CN(C)C

InChI

InChI=1S/C23H30N2OS/c1-18-4-10-22(11-5-18)26-23(27)25-14-12-20(13-15-25)16-19-6-8-21(9-7-19)17-24(2)3/h4-11,20H,12-17H2,1-3H3