N-[2-(cyclohexen-1-yl)ethyl]-2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]propanamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]propanamide Openeye Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]propanamide CAS Name: N-[2-(1-cyclohexenyl)ethyl]-2-[(6-ethoxy-1H-benzimidazol-2-yl)thio]propanamide IUPAC Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]propanamide Traditional Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[(6-ethoxy-1H-benzimidazol-2-yl)thio]propionamide Formula: C20H27N3O2S MolecularWeight: 373.51228

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(N2)SC(C)C(=O)NCCC3=CCCCC3

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(N2)SC(C)C(=O)NCCC3=CCCCC3

InChI

InChI=1S/C20H27N3O2S/c1-3-25-16-9-10-17-18(13-16)23-20(22-17)26-14(2)19(24)21-12-11-15-7-5-4-6-8-15/h7,9-10,13-14H,3-6,8,11-12H2,1-2H3,(H,21,24)(H,22,23)