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

Systemtic Name: N-(2-aminophenyl)-4-[3-chloranyl-5-[(4-ethylpiperazin-1-yl)methyl]pyridin-2-yl]benzamide Openeye Name: N-(2-aminophenyl)-4-[3-chloro-5-[(4-ethylpiperazin-1-yl)methyl]-2-pyridyl]benzamide CAS Name: N-(2-aminophenyl)-4-[3-chloro-5-[(4-ethyl-1-piperazinyl)methyl]-2-pyridinyl]benzamide IUPAC Name: N-(2-aminophenyl)-4-[3-chloro-5-[(4-ethylpiperazin-1-yl)methyl]pyridin-2-yl]benzamide Traditional Name: N-(2-aminophenyl)-4-[3-chloro-5-[(4-ethylpiperazino)methyl]-2-pyridyl]benzamide Formula: C25H28ClN5O MolecularWeight: 449.97572

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC2=CC(=C(N=C2)C3=CC=C(C=C3)C(=O)NC4=CC=CC=C4N)Cl

Isomeric SMILES

CCN1CCN(CC1)CC2=CC(=C(N=C2)C3=CC=C(C=C3)C(=O)NC4=CC=CC=C4N)Cl

InChI

InChI=1S/C25H28ClN5O/c1-2-30-11-13-31(14-12-30)17-18-15-21(26)24(28-16-18)19-7-9-20(10-8-19)25(32)29-23-6-4-3-5-22(23)27/h3-10,15-16H,2,11-14,17,27H2,1H3,(H,29,32)