1-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]-2-(4-pyrrol-1-ylphenyl)ethanone

Systemtic Name: 1-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]-2-(4-pyrrol-1-ylphenyl)ethanone Openeye Name: 1-[4-[2-(azepan-1-yl)-2-oxo-ethyl]piperazin-1-yl]-2-(4-pyrrol-1-ylphenyl)ethanone CAS Name: 1-[4-[2-(1-azepanyl)-2-oxoethyl]-1-piperazinyl]-2-[4-(1-pyrrolyl)phenyl]ethanone IUPAC Name: 1-[4-[2-(azepan-1-yl)-2-oxoethyl]piperazin-1-yl]-2-(4-pyrrol-1-ylphenyl)ethanone Traditional Name: 1-[4-[2-(azepan-1-yl)-2-keto-ethyl]piperazino]-2-(4-pyrrol-1-ylphenyl)ethanone Formula: C24H32N4O2 MolecularWeight: 408.53648

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2CCN(CC2)C(=O)CC3=CC=C(C=C3)N4C=CC=C4

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2CCN(CC2)C(=O)CC3=CC=C(C=C3)N4C=CC=C4

InChI

InChI=1S/C24H32N4O2/c29-23(19-21-7-9-22(10-8-21)26-11-5-6-12-26)28-17-15-25(16-18-28)20-24(30)27-13-3-1-2-4-14-27/h5-12H,1-4,13-20H2