4-[1-(3-methylimidazol-4-yl)pyrrolidin-2-yl]-2-(3-phenylazanylphenoxy)benzenecarbonitrile

Systemtic Name: 4-[1-(3-methylimidazol-4-yl)pyrrolidin-2-yl]-2-(3-phenylazanylphenoxy)benzenecarbonitrile Openeye Name: 2-(3-anilinophenoxy)-4-[1-(3-methylimidazol-4-yl)pyrrolidin-2-yl]benzonitrile CAS Name: 2-(3-anilinophenoxy)-4-[1-(3-methyl-4-imidazolyl)-2-pyrrolidinyl]benzonitrile IUPAC Name: 2-(3-anilinophenoxy)-4-[1-(3-methylimidazol-4-yl)pyrrolidin-2-yl]benzonitrile Traditional Name: 2-(3-anilinophenoxy)-4-[1-(3-methylimidazol-4-yl)pyrrolidin-2-yl]benzonitrile Formula: C27H25N5O MolecularWeight: 435.5203

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1N2CCCC2C3=CC(=C(C=C3)C#N)OC4=CC=CC(=C4)NC5=CC=CC=C5

Isomeric SMILES

CN1C=NC=C1N2CCCC2C3=CC(=C(C=C3)C#N)OC4=CC=CC(=C4)NC5=CC=CC=C5

InChI

InChI=1S/C27H25N5O/c1-31-19-29-18-27(31)32-14-6-11-25(32)20-12-13-21(17-28)26(15-20)33-24-10-5-9-23(16-24)30-22-7-3-2-4-8-22/h2-5,7-10,12-13,15-16,18-19,25,30H,6,11,14H2,1H3