N-(3-chlorophenyl)-2-(12-piperidin-1-yldodecylamino)-4,5-dihydroimidazole-1-carbothioamide

Systemtic Name: N-(3-chlorophenyl)-2-(12-piperidin-1-yldodecylamino)-4,5-dihydroimidazole-1-carbothioamide Openeye Name: N-(3-chlorophenyl)-2-[12-(1-piperidyl)dodecylamino]-4,5-dihydroimidazole-1-carbothioamide CAS Name: N-(3-chlorophenyl)-2-[12-(1-piperidinyl)dodecylamino]-4,5-dihydroimidazole-1-carbothioamide IUPAC Name: N-(3-chlorophenyl)-2-(12-piperidin-1-yldodecylamino)-4,5-dihydroimidazole-1-carbothioamide Traditional Name: N-(3-chlorophenyl)-2-(12-piperidinododecylamino)-2-imidazoline-1-carbothioamide Formula: C27H44ClN5S MolecularWeight: 506.18976

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCCCCCCCCCCNC2=NCCN2C(=S)NC3=CC(=CC=C3)Cl

Isomeric SMILES

C1CCN(CC1)CCCCCCCCCCCCNC2=NCCN2C(=S)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C27H44ClN5S/c28-24-15-14-16-25(23-24)31-27(34)33-22-18-30-26(33)29-17-10-7-5-3-1-2-4-6-8-11-19-32-20-12-9-13-21-32/h14-16,23H,1-13,17-22H2,(H,29,30)(H,31,34)