1-(azepan-1-yl)-3-[2-[(E)-2-(furan-2-yl)ethenyl]benzimidazol-1-yl]propan-1-one

Systemtic Name: 1-(azepan-1-yl)-3-[2-[(E)-2-(furan-2-yl)ethenyl]benzimidazol-1-yl]propan-1-one Openeye Name: 1-(azepan-1-yl)-3-[2-[(E)-2-(2-furyl)vinyl]benzimidazol-1-yl]propan-1-one CAS Name: 1-(1-azepanyl)-3-[2-[(E)-2-(2-furanyl)ethenyl]-1-benzimidazolyl]-1-propanone IUPAC Name: 1-(azepan-1-yl)-3-[2-[(E)-2-(furan-2-yl)ethenyl]benzimidazol-1-yl]propan-1-one Traditional Name: 1-(azepan-1-yl)-3-[2-[(E)-2-(2-furyl)vinyl]benzimidazol-1-yl]propan-1-one Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CCN2C3=CC=CC=C3N=C2C=CC4=CC=CO4

Isomeric SMILES

C1CCCN(CC1)C(=O)CCN2C3=CC=CC=C3N=C2/C=C/C4=CC=CO4

InChI

InChI=1S/C22H25N3O2/c26-22(24-14-5-1-2-6-15-24)13-16-25-20-10-4-3-9-19(20)23-21(25)12-11-18-8-7-17-27-18/h3-4,7-12,17H,1-2,5-6,13-16H2/b12-11+