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

Systemtic Name: 4-(2-chloranylpyrimidin-4-yl)-N-[2-(3-cyano-1H-indol-5-yl)ethyl]benzamide Openeye Name: 4-(2-chloropyrimidin-4-yl)-N-[2-(3-cyano-1H-indol-5-yl)ethyl]benzamide CAS Name: 4-(2-chloro-4-pyrimidinyl)-N-[2-(3-cyano-1H-indol-5-yl)ethyl]benzamide IUPAC Name: 4-(2-chloropyrimidin-4-yl)-N-[2-(3-cyano-1H-indol-5-yl)ethyl]benzamide Traditional Name: 4-(2-chloropyrimidin-4-yl)-N-[2-(3-cyano-1H-indol-5-yl)ethyl]benzamide Formula: C22H16ClN5O MolecularWeight: 401.84834

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=NC=C2)Cl)C(=O)NCCC3=CC4=C(C=C3)NC=C4C#N

Isomeric SMILES

C1=CC(=CC=C1C2=NC(=NC=C2)Cl)C(=O)NCCC3=CC4=C(C=C3)NC=C4C#N

InChI

InChI=1S/C22H16ClN5O/c23-22-26-10-8-19(28-22)15-2-4-16(5-3-15)21(29)25-9-7-14-1-6-20-18(11-14)17(12-24)13-27-20/h1-6,8,10-11,13,27H,7,9H2,(H,25,29)