N-(1,3-benzodioxol-5-yl)-1-[2-(benzotriazol-1-yl)ethanoyl-(pyridin-3-ylmethyl)amino]cyclopentane-1-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[2-(benzotriazol-1-yl)ethanoyl-(pyridin-3-ylmethyl)amino]cyclopentane-1-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-[[2-(benzotriazol-1-yl)acetyl]-(3-pyridylmethyl)amino]cyclopentanecarboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[[2-(1-benzotriazolyl)-1-oxoethyl]-(3-pyridinylmethyl)amino]-1-cyclopentanecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-[[2-(benzotriazol-1-yl)acetyl]-(pyridin-3-ylmethyl)amino]cyclopentane-1-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-[[2-(benzotriazol-1-yl)acetyl]-(3-pyridylmethyl)amino]cyclopentanecarboxamide Formula: C27H26N6O4 MolecularWeight: 498.53314

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C(=O)NC2=CC3=C(C=C2)OCO3)N(CC4=CN=CC=C4)C(=O)CN5C6=CC=CC=C6N=N5

Isomeric SMILES

C1CCC(C1)(C(=O)NC2=CC3=C(C=C2)OCO3)N(CC4=CN=CC=C4)C(=O)CN5C6=CC=CC=C6N=N5

InChI

InChI=1S/C27H26N6O4/c34-25(17-33-22-8-2-1-7-21(22)30-31-33)32(16-19-6-5-13-28-15-19)27(11-3-4-12-27)26(35)29-20-9-10-23-24(14-20)37-18-36-23/h1-2,5-10,13-15H,3-4,11-12,16-18H2,(H,29,35)