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

Systemtic Name: N-(furan-2-ylmethyl)-4-[1-(4-phenylmethoxybutyl)imidazol-2-yl]piperidine-1-carbothioamide Openeye Name: 4-[1-(4-benzyloxybutyl)imidazol-2-yl]-N-(2-furylmethyl)piperidine-1-carbothioamide CAS Name: N-(2-furanylmethyl)-4-[1-(4-phenylmethoxybutyl)-2-imidazolyl]-1-piperidinecarbothioamide IUPAC Name: N-(furan-2-ylmethyl)-4-[1-(4-phenylmethoxybutyl)imidazol-2-yl]piperidine-1-carbothioamide Traditional Name: 4-[1-(4-benzoxybutyl)imidazol-2-yl]-N-(2-furfuryl)piperidine-1-carbothioamide Formula: C25H32N4O2S MolecularWeight: 452.61218

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC=CN2CCCCOCC3=CC=CC=C3)C(=S)NCC4=CC=CO4

Isomeric SMILES

C1CN(CCC1C2=NC=CN2CCCCOCC3=CC=CC=C3)C(=S)NCC4=CC=CO4

InChI

InChI=1S/C25H32N4O2S/c32-25(27-19-23-9-6-18-31-23)29-14-10-22(11-15-29)24-26-12-16-28(24)13-4-5-17-30-20-21-7-2-1-3-8-21/h1-3,6-9,12,16,18,22H,4-5,10-11,13-15,17,19-20H2,(H,27,32)