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

Systemtic Name: N-[2-(3-cyano-1H-indol-5-yl)ethyl]-4-(2-piperidin-1-ylpyrimidin-4-yl)benzamide Openeye Name: N-[2-(3-cyano-1H-indol-5-yl)ethyl]-4-[2-(1-piperidyl)pyrimidin-4-yl]benzamide CAS Name: N-[2-(3-cyano-1H-indol-5-yl)ethyl]-4-[2-(1-piperidinyl)-4-pyrimidinyl]benzamide IUPAC Name: N-[2-(3-cyano-1H-indol-5-yl)ethyl]-4-(2-piperidin-1-ylpyrimidin-4-yl)benzamide Traditional Name: N-[2-(3-cyano-1H-indol-5-yl)ethyl]-4-(2-piperidinopyrimidin-4-yl)benzamide Formula: C27H26N6O MolecularWeight: 450.53494

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC=CC(=N2)C3=CC=C(C=C3)C(=O)NCCC4=CC5=C(C=C4)NC=C5C#N

Isomeric SMILES

C1CCN(CC1)C2=NC=CC(=N2)C3=CC=C(C=C3)C(=O)NCCC4=CC5=C(C=C4)NC=C5C#N

InChI

InChI=1S/C27H26N6O/c28-17-22-18-31-25-9-4-19(16-23(22)25)10-12-29-26(34)21-7-5-20(6-8-21)24-11-13-30-27(32-24)33-14-2-1-3-15-33/h4-9,11,13,16,18,31H,1-3,10,12,14-15H2,(H,29,34)