N-(2-aminophenyl)-4-[3-cyano-5-[(2-piperidin-1-ylethylamino)methyl]pyridin-2-yl]benzamide

Systemtic Name: N-(2-aminophenyl)-4-[3-cyano-5-[(2-piperidin-1-ylethylamino)methyl]pyridin-2-yl]benzamide Openeye Name: N-(2-aminophenyl)-4-[3-cyano-5-[[2-(1-piperidyl)ethylamino]methyl]-2-pyridyl]benzamide CAS Name: N-(2-aminophenyl)-4-[3-cyano-5-[[2-(1-piperidinyl)ethylamino]methyl]-2-pyridinyl]benzamide IUPAC Name: N-(2-aminophenyl)-4-[3-cyano-5-[(2-piperidin-1-ylethylamino)methyl]pyridin-2-yl]benzamide Traditional Name: N-(2-aminophenyl)-4-[3-cyano-5-[(2-piperidinoethylamino)methyl]-2-pyridyl]benzamide Formula: C27H30N6O MolecularWeight: 454.5667

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCNCC2=CN=C(C(=C2)C#N)C3=CC=C(C=C3)C(=O)NC4=CC=CC=C4N

Isomeric SMILES

C1CCN(CC1)CCNCC2=CN=C(C(=C2)C#N)C3=CC=C(C=C3)C(=O)NC4=CC=CC=C4N

InChI

InChI=1S/C27H30N6O/c28-17-23-16-20(18-30-12-15-33-13-4-1-5-14-33)19-31-26(23)21-8-10-22(11-9-21)27(34)32-25-7-3-2-6-24(25)29/h2-3,6-11,16,19,30H,1,4-5,12-15,18,29H2,(H,32,34)