1-(3,4-dimethoxyphenyl)-2-(1-hexylbenzimidazol-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(3,4-dimethoxyphenyl)-2-(1-hexylbenzimidazol-2-yl)sulfanyl-ethanone Openeye Name: 1-(3,4-dimethoxyphenyl)-2-(1-hexylbenzimidazol-2-yl)sulfanyl-ethanone CAS Name: 1-(3,4-dimethoxyphenyl)-2-[(1-hexyl-2-benzimidazolyl)thio]ethanone IUPAC Name: 1-(3,4-dimethoxyphenyl)-2-(1-hexylbenzimidazol-2-yl)sulfanylethanone Traditional Name: 1-(3,4-dimethoxyphenyl)-2-[(1-hexylbenzimidazol-2-yl)thio]ethanone Formula: C23H28N2O3S MolecularWeight: 412.54502

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2N=C1SCC(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2N=C1SCC(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C23H28N2O3S/c1-4-5-6-9-14-25-19-11-8-7-10-18(19)24-23(25)29-16-20(26)17-12-13-21(27-2)22(15-17)28-3/h7-8,10-13,15H,4-6,9,14,16H2,1-3H3