N-(3-chlorophenyl)-2-[[(1E)-hepta-1,6-dienyl]amino]-4,5-dihydroimidazole-1-carbothioamide

Systemtic Name: N-(3-chlorophenyl)-2-[[(1E)-hepta-1,6-dienyl]amino]-4,5-dihydroimidazole-1-carbothioamide Openeye Name: N-(3-chlorophenyl)-2-[[(1E)-hepta-1,6-dienyl]amino]-4,5-dihydroimidazole-1-carbothioamide CAS Name: N-(3-chlorophenyl)-2-[[(1E)-hepta-1,6-dienyl]amino]-4,5-dihydroimidazole-1-carbothioamide IUPAC Name: N-(3-chlorophenyl)-2-[[(1E)-hepta-1,6-dienyl]amino]-4,5-dihydroimidazole-1-carbothioamide Traditional Name: N-(3-chlorophenyl)-2-[[(1E)-hepta-1,6-dienyl]amino]-2-imidazoline-1-carbothioamide Formula: C17H21ClN4S MolecularWeight: 348.89344

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCC=CNC1=NCCN1C(=S)NC2=CC(=CC=C2)Cl

Isomeric SMILES

C=CCCC/C=C/NC1=NCCN1C(=S)NC2=CC(=CC=C2)Cl

InChI

InChI=1S/C17H21ClN4S/c1-2-3-4-5-6-10-19-16-20-11-12-22(16)17(23)21-15-9-7-8-14(18)13-15/h2,6-10,13H,1,3-5,11-12H2,(H,19,20)(H,21,23)/b10-6+