2-[4-[4-(1H-indol-3-yl)piperidin-1-yl]carbonylpiperidin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[4-(1H-indol-3-yl)piperidin-1-yl]carbonylpiperidin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-1-piperidyl]sulfonyl]benzonitrile CAS Name: 2-[[4-[[4-(1H-indol-3-yl)-1-piperidinyl]-oxomethyl]-1-piperidinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]piperidin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]piperidino]sulfonylbenzonitrile Formula: C26H28N4O3S MolecularWeight: 476.59052

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CNC3=CC=CC=C32)C(=O)C4CCN(CC4)S(=O)(=O)C5=CC=CC=C5C#N

Isomeric SMILES

C1CN(CCC1C2=CNC3=CC=CC=C32)C(=O)C4CCN(CC4)S(=O)(=O)C5=CC=CC=C5C#N

InChI

InChI=1S/C26H28N4O3S/c27-17-21-5-1-4-8-25(21)34(32,33)30-15-11-20(12-16-30)26(31)29-13-9-19(10-14-29)23-18-28-24-7-3-2-6-22(23)24/h1-8,18-20,28H,9-16H2