4-[1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]benzimidazol-2-yl]-1-(4-methoxyphenyl)pyrrolidin-2-one

Systemtic Name: 4-[1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]benzimidazol-2-yl]-1-(4-methoxyphenyl)pyrrolidin-2-one Openeye Name: 4-[1-[2-(azepan-1-yl)-2-oxo-ethyl]benzimidazol-2-yl]-1-(4-methoxyphenyl)pyrrolidin-2-one CAS Name: 4-[1-[2-(1-azepanyl)-2-oxoethyl]-2-benzimidazolyl]-1-(4-methoxyphenyl)-2-pyrrolidinone IUPAC Name: 4-[1-[2-(azepan-1-yl)-2-oxoethyl]benzimidazol-2-yl]-1-(4-methoxyphenyl)pyrrolidin-2-one Traditional Name: 4-[1-[2-(azepan-1-yl)-2-keto-ethyl]benzimidazol-2-yl]-1-(4-methoxyphenyl)-2-pyrrolidone Formula: C26H30N4O3 MolecularWeight: 446.5414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CC(CC2=O)C3=NC4=CC=CC=C4N3CC(=O)N5CCCCCC5

Isomeric SMILES

COC1=CC=C(C=C1)N2CC(CC2=O)C3=NC4=CC=CC=C4N3CC(=O)N5CCCCCC5

InChI

InChI=1S/C26H30N4O3/c1-33-21-12-10-20(11-13-21)29-17-19(16-24(29)31)26-27-22-8-4-5-9-23(22)30(26)18-25(32)28-14-6-2-3-7-15-28/h4-5,8-13,19H,2-3,6-7,14-18H2,1H3