N-[2-(3-cyano-1H-indol-5-yl)ethyl]-4-(2-pyrrolidin-1-ylpyrimidin-4-yl)benzamide

Systemtic Name: N-[2-(3-cyano-1H-indol-5-yl)ethyl]-4-(2-pyrrolidin-1-ylpyrimidin-4-yl)benzamide Openeye Name: N-[2-(3-cyano-1H-indol-5-yl)ethyl]-4-(2-pyrrolidin-1-ylpyrimidin-4-yl)benzamide CAS Name: N-[2-(3-cyano-1H-indol-5-yl)ethyl]-4-[2-(1-pyrrolidinyl)-4-pyrimidinyl]benzamide IUPAC Name: N-[2-(3-cyano-1H-indol-5-yl)ethyl]-4-(2-pyrrolidin-1-ylpyrimidin-4-yl)benzamide Traditional Name: N-[2-(3-cyano-1H-indol-5-yl)ethyl]-4-(2-pyrrolidinopyrimidin-4-yl)benzamide Formula: C26H24N6O MolecularWeight: 436.50836

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC=CC(=N2)C3=CC=C(C=C3)C(=O)NCCC4=CC5=C(C=C4)NC=C5C#N

Isomeric SMILES

C1CCN(C1)C2=NC=CC(=N2)C3=CC=C(C=C3)C(=O)NCCC4=CC5=C(C=C4)NC=C5C#N

InChI

InChI=1S/C26H24N6O/c27-16-21-17-30-24-8-3-18(15-22(21)24)9-11-28-25(33)20-6-4-19(5-7-20)23-10-12-29-26(31-23)32-13-1-2-14-32/h3-8,10,12,15,17,30H,1-2,9,11,13-14H2,(H,28,33)