2-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 2-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 2-[4-[2-(azepan-1-yl)-2-oxo-ethyl]piperazin-1-yl]pyridine-3-carbonitrile CAS Name: 2-[4-[2-(1-azepanyl)-2-oxoethyl]-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 2-[4-[2-(azepan-1-yl)-2-oxoethyl]piperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 2-[4-[2-(azepan-1-yl)-2-keto-ethyl]piperazino]nicotinonitrile Formula: C18H25N5O MolecularWeight: 327.424

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2CCN(CC2)C3=C(C=CC=N3)C#N

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2CCN(CC2)C3=C(C=CC=N3)C#N

InChI

InChI=1S/C18H25N5O/c19-14-16-6-5-7-20-18(16)23-12-10-21(11-13-23)15-17(24)22-8-3-1-2-4-9-22/h5-7H,1-4,8-13,15H2