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

Systemtic Name: N-(2-aminophenyl)-4-[3-cyano-5-[(4-cyclopropylcarbonylpiperazin-1-yl)methyl]pyridin-2-yl]benzamide Openeye Name: N-(2-aminophenyl)-4-[3-cyano-5-[[4-(cyclopropanecarbonyl)piperazin-1-yl]methyl]-2-pyridyl]benzamide CAS Name: N-(2-aminophenyl)-4-[3-cyano-5-[[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]methyl]-2-pyridinyl]benzamide IUPAC Name: N-(2-aminophenyl)-4-[3-cyano-5-[[4-(cyclopropanecarbonyl)piperazin-1-yl]methyl]pyridin-2-yl]benzamide Traditional Name: N-(2-aminophenyl)-4-[3-cyano-5-[[4-(cyclopropanecarbonyl)piperazino]methyl]-2-pyridyl]benzamide Formula: C28H28N6O2 MolecularWeight: 480.56092

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CCN(CC2)CC3=CN=C(C(=C3)C#N)C4=CC=C(C=C4)C(=O)NC5=CC=CC=C5N

Isomeric SMILES

C1CC1C(=O)N2CCN(CC2)CC3=CN=C(C(=C3)C#N)C4=CC=C(C=C4)C(=O)NC5=CC=CC=C5N

InChI

InChI=1S/C28H28N6O2/c29-16-23-15-19(18-33-11-13-34(14-12-33)28(36)22-9-10-22)17-31-26(23)20-5-7-21(8-6-20)27(35)32-25-4-2-1-3-24(25)30/h1-8,15,17,22H,9-14,18,30H2,(H,32,35)