2-[4-[1-butyl-2-(4-methoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylpiperazin-1-yl]pyridine-4-carbonitrile

Systemtic Name: 2-[4-[1-butyl-2-(4-methoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylpiperazin-1-yl]pyridine-4-carbonitrile Openeye Name: 2-[4-[1-butyl-2-(4-methoxyphenyl)-5-oxo-pyrrolidine-3-carbonyl]piperazin-1-yl]pyridine-4-carbonitrile CAS Name: 2-[4-[[1-butyl-2-(4-methoxyphenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]-1-piperazinyl]-4-pyridinecarbonitrile IUPAC Name: 2-[4-[1-butyl-2-(4-methoxyphenyl)-5-oxopyrrolidine-3-carbonyl]piperazin-1-yl]pyridine-4-carbonitrile Traditional Name: 2-[4-[1-butyl-5-keto-2-(4-methoxyphenyl)pyrrolidine-3-carbonyl]piperazino]isonicotinonitrile Formula: C26H31N5O3 MolecularWeight: 461.55604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(C(CC1=O)C(=O)N2CCN(CC2)C3=NC=CC(=C3)C#N)C4=CC=C(C=C4)OC

Isomeric SMILES

CCCCN1C(C(CC1=O)C(=O)N2CCN(CC2)C3=NC=CC(=C3)C#N)C4=CC=C(C=C4)OC

InChI

InChI=1S/C26H31N5O3/c1-3-4-11-31-24(32)17-22(25(31)20-5-7-21(34-2)8-6-20)26(33)30-14-12-29(13-15-30)23-16-19(18-27)9-10-28-23/h5-10,16,22,25H,3-4,11-15,17H2,1-2H3