N-(3-chlorophenyl)-2-(hexylamino)-4-methyl-4,5-dihydroimidazole-1-carbothioamide

Systemtic Name: N-(3-chlorophenyl)-2-(hexylamino)-4-methyl-4,5-dihydroimidazole-1-carbothioamide Openeye Name: N-(3-chlorophenyl)-2-(hexylamino)-4-methyl-4,5-dihydroimidazole-1-carbothioamide CAS Name: N-(3-chlorophenyl)-2-(hexylamino)-4-methyl-4,5-dihydroimidazole-1-carbothioamide IUPAC Name: N-(3-chlorophenyl)-2-(hexylamino)-4-methyl-4,5-dihydroimidazole-1-carbothioamide Traditional Name: N-(3-chlorophenyl)-2-(hexylamino)-4-methyl-2-imidazoline-1-carbothioamide Formula: C17H25ClN4S MolecularWeight: 352.9252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC1=NC(CN1C(=S)NC2=CC(=CC=C2)Cl)C

Isomeric SMILES

CCCCCCNC1=NC(CN1C(=S)NC2=CC(=CC=C2)Cl)C

InChI

InChI=1S/C17H25ClN4S/c1-3-4-5-6-10-19-16-20-13(2)12-22(16)17(23)21-15-9-7-8-14(18)11-15/h7-9,11,13H,3-6,10,12H2,1-2H3,(H,19,20)(H,21,23)