N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(phenylmethyl)piperidine-1-carbothioamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(phenylmethyl)piperidine-1-carbothioamide Openeye Name: 4-benzyl-N-[2-(3,4-dimethoxyphenyl)ethyl]piperidine-1-carbothioamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(phenylmethyl)-1-piperidinecarbothioamide IUPAC Name: 4-benzyl-N-[2-(3,4-dimethoxyphenyl)ethyl]piperidine-1-carbothioamide Traditional Name: 4-benzyl-N-homoveratryl-piperidine-1-carbothioamide Formula: C23H30N2O2S MolecularWeight: 398.5615

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=S)N2CCC(CC2)CC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=S)N2CCC(CC2)CC3=CC=CC=C3)OC

InChI

InChI=1S/C23H30N2O2S/c1-26-21-9-8-19(17-22(21)27-2)10-13-24-23(28)25-14-11-20(12-15-25)16-18-6-4-3-5-7-18/h3-9,17,20H,10-16H2,1-2H3,(H,24,28)