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

Systemtic Name: 2-[3-(3-ethyl-1-methyl-2-oxidanylidene-piperidin-3-yl)phenoxy]-4-[2-(3-methylimidazol-4-yl)pyrrolidin-2-yl]benzenecarbonitrile Openeye Name: 2-[3-(3-ethyl-1-methyl-2-oxo-3-piperidyl)phenoxy]-4-[2-(3-methylimidazol-4-yl)pyrrolidin-2-yl]benzonitrile CAS Name: 2-[3-(3-ethyl-1-methyl-2-oxo-3-piperidinyl)phenoxy]-4-[2-(3-methyl-4-imidazolyl)-2-pyrrolidinyl]benzonitrile IUPAC Name: 2-[3-(3-ethyl-1-methyl-2-oxopiperidin-3-yl)phenoxy]-4-[2-(3-methylimidazol-4-yl)pyrrolidin-2-yl]benzonitrile Traditional Name: 2-[3-(3-ethyl-2-keto-1-methyl-3-piperidyl)phenoxy]-4-[2-(3-methylimidazol-4-yl)pyrrolidin-2-yl]benzonitrile Formula: C29H33N5O2 MolecularWeight: 483.60462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H33N5O2/c1-4-28(12-7-15-33(2)27(28)35)22-8-5-9-24(16-22)36-25-17-23(11-10-21(25)18-30)29(13-6-14-32-29)26-19-31-20-34(26)3/h5,8-11,16-17,19-20,32H,4,6-7,12-15H2,1-3H3