N-[4-(azepan-1-yl)phenyl]-2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-[4-(azepan-1-yl)phenyl]-2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-acetamide CAS Name: N-[4-(1-azepanyl)phenyl]-2-[[1-(2-methoxyethyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: N-[4-(azepan-1-yl)phenyl]-2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylacetamide Traditional Name: N-[4-(azepan-1-yl)phenyl]-2-[[1-(2-methoxyethyl)benzimidazol-2-yl]thio]acetamide Formula: C24H30N4O2S MolecularWeight: 438.5856

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=CC=CC=C2N=C1SCC(=O)NC3=CC=C(C=C3)N4CCCCCC4

Isomeric SMILES

COCCN1C2=CC=CC=C2N=C1SCC(=O)NC3=CC=C(C=C3)N4CCCCCC4

InChI

InChI=1S/C24H30N4O2S/c1-30-17-16-28-22-9-5-4-8-21(22)26-24(28)31-18-23(29)25-19-10-12-20(13-11-19)27-14-6-2-3-7-15-27/h4-5,8-13H,2-3,6-7,14-18H2,1H3,(H,25,29)