N-(4-phenylbutyl)-4-[1-(4-phenylmethoxybutyl)imidazol-2-yl]piperidine-1-carbothioamide

Systemtic Name: N-(4-phenylbutyl)-4-[1-(4-phenylmethoxybutyl)imidazol-2-yl]piperidine-1-carbothioamide Openeye Name: 4-[1-(4-benzyloxybutyl)imidazol-2-yl]-N-(4-phenylbutyl)piperidine-1-carbothioamide CAS Name: N-(4-phenylbutyl)-4-[1-(4-phenylmethoxybutyl)-2-imidazolyl]-1-piperidinecarbothioamide IUPAC Name: N-(4-phenylbutyl)-4-[1-(4-phenylmethoxybutyl)imidazol-2-yl]piperidine-1-carbothioamide Traditional Name: 4-[1-(4-benzoxybutyl)imidazol-2-yl]-N-(4-phenylbutyl)piperidine-1-carbothioamide Formula: C30H40N4OS MolecularWeight: 504.7298

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC=CN2CCCCOCC3=CC=CC=C3)C(=S)NCCCCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C2=NC=CN2CCCCOCC3=CC=CC=C3)C(=S)NCCCCC4=CC=CC=C4

InChI

InChI=1S/C30H40N4OS/c36-30(32-18-8-7-13-26-11-3-1-4-12-26)34-21-16-28(17-22-34)29-31-19-23-33(29)20-9-10-24-35-25-27-14-5-2-6-15-27/h1-6,11-12,14-15,19,23,28H,7-10,13,16-18,20-22,24-25H2,(H,32,36)