N-[3-[1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]benzimidazol-2-yl]propyl]thiophene-2-carboxamide

Systemtic Name: N-[3-[1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]benzimidazol-2-yl]propyl]thiophene-2-carboxamide Openeye Name: N-[3-[1-[2-(azepan-1-yl)-2-oxo-ethyl]benzimidazol-2-yl]propyl]thiophene-2-carboxamide CAS Name: N-[3-[1-[2-(1-azepanyl)-2-oxoethyl]-2-benzimidazolyl]propyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[1-[2-(azepan-1-yl)-2-oxoethyl]benzimidazol-2-yl]propyl]thiophene-2-carboxamide Traditional Name: N-[3-[1-[2-(azepan-1-yl)-2-keto-ethyl]benzimidazol-2-yl]propyl]thiophene-2-carboxamide Formula: C23H28N4O2S MolecularWeight: 424.55902

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2C3=CC=CC=C3N=C2CCCNC(=O)C4=CC=CS4

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2C3=CC=CC=C3N=C2CCCNC(=O)C4=CC=CS4

InChI

InChI=1S/C23H28N4O2S/c28-22(26-14-5-1-2-6-15-26)17-27-19-10-4-3-9-18(19)25-21(27)12-7-13-24-23(29)20-11-8-16-30-20/h3-4,8-11,16H,1-2,5-7,12-15,17H2,(H,24,29)