2-azanyl-N-[1-[2-[(3,5-dimethylphenyl)-pyridin-2-yl-amino]ethyl]piperidin-4-yl]benzamide

Systemtic Name: 2-azanyl-N-[1-[2-[(3,5-dimethylphenyl)-pyridin-2-yl-amino]ethyl]piperidin-4-yl]benzamide Openeye Name: 2-amino-N-[1-[2-[3,5-dimethyl-N-(2-pyridyl)anilino]ethyl]-4-piperidyl]benzamide CAS Name: 2-amino-N-[1-[2-[3,5-dimethyl-N-(2-pyridinyl)anilino]ethyl]-4-piperidinyl]benzamide IUPAC Name: 2-amino-N-[1-[2-(3,5-dimethyl-N-pyridin-2-ylanilino)ethyl]piperidin-4-yl]benzamide Traditional Name: 2-amino-N-[1-[2-[3,5-dimethyl-N-(2-pyridyl)anilino]ethyl]-4-piperidyl]benzamide Formula: C27H33N5O MolecularWeight: 443.58382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(CCN2CCC(CC2)NC(=O)C3=CC=CC=C3N)C4=CC=CC=N4)C

Isomeric SMILES

CC1=CC(=CC(=C1)N(CCN2CCC(CC2)NC(=O)C3=CC=CC=C3N)C4=CC=CC=N4)C

InChI

InChI=1S/C27H33N5O/c1-20-17-21(2)19-23(18-20)32(26-9-5-6-12-29-26)16-15-31-13-10-22(11-14-31)30-27(33)24-7-3-4-8-25(24)28/h3-9,12,17-19,22H,10-11,13-16,28H2,1-2H3,(H,30,33)