6-[3-oxidanylidene-4-[(1-pyridin-4-ylpiperidin-4-yl)methyl]piperazin-1-yl]sulfonylnaphthalene-2-carbonitrile

Systemtic Name: 6-[3-oxidanylidene-4-[(1-pyridin-4-ylpiperidin-4-yl)methyl]piperazin-1-yl]sulfonylnaphthalene-2-carbonitrile Openeye Name: 6-[3-oxo-4-[[1-(4-pyridyl)-4-piperidyl]methyl]piperazin-1-yl]sulfonylnaphthalene-2-carbonitrile CAS Name: 6-[[3-oxo-4-[(1-pyridin-4-yl-4-piperidinyl)methyl]-1-piperazinyl]sulfonyl]-2-naphthalenecarbonitrile IUPAC Name: 6-[3-oxo-4-[(1-pyridin-4-ylpiperidin-4-yl)methyl]piperazin-1-yl]sulfonylnaphthalene-2-carbonitrile Traditional Name: 6-[3-keto-4-[[1-(4-pyridyl)-4-piperidyl]methyl]piperazino]sulfonylnaphthalene-2-carbonitrile Formula: C26H27N5O3S MolecularWeight: 489.58928

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2CCN(CC2=O)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)C#N)C5=CC=NC=C5

Isomeric SMILES

C1CN(CCC1CN2CCN(CC2=O)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)C#N)C5=CC=NC=C5

InChI

InChI=1S/C26H27N5O3S/c27-17-21-1-2-23-16-25(4-3-22(23)15-21)35(33,34)31-14-13-30(26(32)19-31)18-20-7-11-29(12-8-20)24-5-9-28-10-6-24/h1-6,9-10,15-16,20H,7-8,11-14,18-19H2