2-[3-(3-ethyl-1-methyl-2-oxidanylidene-pyrrolidin-3-yl)phenoxy]-4-[2-(3-methylimidazol-4-yl)pyrrolidin-2-yl]benzenecarbonitrile

Systemtic Name: 2-[3-(3-ethyl-1-methyl-2-oxidanylidene-pyrrolidin-3-yl)phenoxy]-4-[2-(3-methylimidazol-4-yl)pyrrolidin-2-yl]benzenecarbonitrile Openeye Name: 2-[3-(3-ethyl-1-methyl-2-oxo-pyrrolidin-3-yl)phenoxy]-4-[2-(3-methylimidazol-4-yl)pyrrolidin-2-yl]benzonitrile CAS Name: 2-[3-(3-ethyl-1-methyl-2-oxo-3-pyrrolidinyl)phenoxy]-4-[2-(3-methyl-4-imidazolyl)-2-pyrrolidinyl]benzonitrile IUPAC Name: 2-[3-(3-ethyl-1-methyl-2-oxopyrrolidin-3-yl)phenoxy]-4-[2-(3-methylimidazol-4-yl)pyrrolidin-2-yl]benzonitrile Traditional Name: 2-[3-(3-ethyl-2-keto-1-methyl-pyrrolidin-3-yl)phenoxy]-4-[2-(3-methylimidazol-4-yl)pyrrolidin-2-yl]benzonitrile Formula: C28H31N5O2 MolecularWeight: 469.57804

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCN(C1=O)C)C2=CC(=CC=C2)OC3=C(C=CC(=C3)C4(CCCN4)C5=CN=CN5C)C#N

Isomeric SMILES

CCC1(CCN(C1=O)C)C2=CC(=CC=C2)OC3=C(C=CC(=C3)C4(CCCN4)C5=CN=CN5C)C#N

InChI

InChI=1S/C28H31N5O2/c1-4-27(12-14-32(2)26(27)34)21-7-5-8-23(15-21)35-24-16-22(10-9-20(24)17-29)28(11-6-13-31-28)25-18-30-19-33(25)3/h5,7-10,15-16,18-19,31H,4,6,11-14H2,1-3H3