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

Systemtic Name: N-[2-[1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]benzimidazol-2-yl]ethyl]thiophene-2-carboxamide Openeye Name: N-[2-[1-[2-(azepan-1-yl)-2-oxo-ethyl]benzimidazol-2-yl]ethyl]thiophene-2-carboxamide CAS Name: N-[2-[1-[2-(1-azepanyl)-2-oxoethyl]-2-benzimidazolyl]ethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[1-[2-(azepan-1-yl)-2-oxoethyl]benzimidazol-2-yl]ethyl]thiophene-2-carboxamide Traditional Name: N-[2-[1-[2-(azepan-1-yl)-2-keto-ethyl]benzimidazol-2-yl]ethyl]thiophene-2-carboxamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2C3=CC=CC=C3N=C2CCNC(=O)C4=CC=CS4

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2C3=CC=CC=C3N=C2CCNC(=O)C4=CC=CS4

InChI

InChI=1S/C22H26N4O2S/c27-21(25-13-5-1-2-6-14-25)16-26-18-9-4-3-8-17(18)24-20(26)11-12-23-22(28)19-10-7-15-29-19/h3-4,7-10,15H,1-2,5-6,11-14,16H2,(H,23,28)