N-phenethyl-4-[3-[1-(phenethylcarbamothioyl)piperidin-4-yl]propyl]piperidine-1-carbothioamide

Systemtic Name: N-phenethyl-4-[3-[1-(phenethylcarbamothioyl)piperidin-4-yl]propyl]piperidine-1-carbothioamide Openeye Name: N-phenethyl-4-[3-[1-(phenethylcarbamothioyl)-4-piperidyl]propyl]piperidine-1-carbothioamide CAS Name: N-phenethyl-4-[3-[1-[(phenethylamino)-sulfanylidenemethyl]-4-piperidinyl]propyl]-1-piperidinecarbothioamide IUPAC Name: N-phenethyl-4-[3-[1-(phenethylcarbamothioyl)piperidin-4-yl]propyl]piperidine-1-carbothioamide Traditional Name: N-phenethyl-4-[3-[1-(phenethylthiocarbamoyl)-4-piperidyl]propyl]piperidine-1-carbothioamide Formula: C31H44N4S2 MolecularWeight: 536.83786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCCC2CCN(CC2)C(=S)NCCC3=CC=CC=C3)C(=S)NCCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1CCCC2CCN(CC2)C(=S)NCCC3=CC=CC=C3)C(=S)NCCC4=CC=CC=C4

InChI

InChI=1S/C31H44N4S2/c36-30(32-20-14-26-8-3-1-4-9-26)34-22-16-28(17-23-34)12-7-13-29-18-24-35(25-19-29)31(37)33-21-15-27-10-5-2-6-11-27/h1-6,8-11,28-29H,7,12-25H2,(H,32,36)(H,33,37)