azepan-1-yl-[1-(5-pyrrol-1-ylpyridin-2-yl)piperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-(5-pyrrol-1-ylpyridin-2-yl)piperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-(5-pyrrol-1-yl-2-pyridyl)-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[5-(1-pyrrolyl)-2-pyridinyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-(5-pyrrol-1-ylpyridin-2-yl)piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-(5-pyrrol-1-yl-2-pyridyl)-4-piperidyl]methanone Formula: C21H28N4O MolecularWeight: 352.47322

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)C3=NC=C(C=C3)N4C=CC=C4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)C3=NC=C(C=C3)N4C=CC=C4

InChI

InChI=1S/C21H28N4O/c26-21(25-13-3-1-2-4-14-25)18-9-15-24(16-10-18)20-8-7-19(17-22-20)23-11-5-6-12-23/h5-8,11-12,17-18H,1-4,9-10,13-16H2