4-[4-[3-(benzotriazol-1-yl)propylamino]piperidin-1-yl]-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 4-[4-[3-(benzotriazol-1-yl)propylamino]piperidin-1-yl]-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 4-[4-[3-(benzotriazol-1-yl)propylamino]-1-piperidyl]-N-(3-pyridylmethyl)benzamide CAS Name: 4-[4-[3-(1-benzotriazolyl)propylamino]-1-piperidinyl]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 4-[4-[3-(benzotriazol-1-yl)propylamino]piperidin-1-yl]-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 4-[4-[3-(benzotriazol-1-yl)propylamino]piperidino]-N-(3-pyridylmethyl)benzamide Formula: C27H31N7O MolecularWeight: 469.58134

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NCCCN2C3=CC=CC=C3N=N2)C4=CC=C(C=C4)C(=O)NCC5=CN=CC=C5

Isomeric SMILES

C1CN(CCC1NCCCN2C3=CC=CC=C3N=N2)C4=CC=C(C=C4)C(=O)NCC5=CN=CC=C5

InChI

InChI=1S/C27H31N7O/c35-27(30-20-21-5-3-14-28-19-21)22-8-10-24(11-9-22)33-17-12-23(13-18-33)29-15-4-16-34-26-7-2-1-6-25(26)31-32-34/h1-3,5-11,14,19,23,29H,4,12-13,15-18,20H2,(H,30,35)