6-[4-[(3-ethyl-2-oxidanylidene-1H-quinolin-7-yl)methyl]piperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 6-[4-[(3-ethyl-2-oxidanylidene-1H-quinolin-7-yl)methyl]piperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 6-[4-[(3-ethyl-2-oxo-1H-quinolin-7-yl)methyl]piperazin-1-yl]pyridine-3-carbonitrile CAS Name: 6-[4-[(3-ethyl-2-oxo-1H-quinolin-7-yl)methyl]-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 6-[4-[(3-ethyl-2-oxo-1H-quinolin-7-yl)methyl]piperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 6-[4-[(3-ethyl-2-keto-1H-quinolin-7-yl)methyl]piperazino]nicotinonitrile Formula: C22H23N5O MolecularWeight: 373.45092

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C(C=C2)CN3CCN(CC3)C4=NC=C(C=C4)C#N)NC1=O

Isomeric SMILES

CCC1=CC2=C(C=C(C=C2)CN3CCN(CC3)C4=NC=C(C=C4)C#N)NC1=O

InChI

InChI=1S/C22H23N5O/c1-2-18-12-19-5-3-16(11-20(19)25-22(18)28)15-26-7-9-27(10-8-26)21-6-4-17(13-23)14-24-21/h3-6,11-12,14H,2,7-10,15H2,1H3,(H,25,28)