(2E)-2-[[4-[4-(benzotriazol-1-yl)piperidin-1-yl]pyridin-3-yl]methylidene]hexanamide

Systemtic Name: (2E)-2-[[4-[4-(benzotriazol-1-yl)piperidin-1-yl]pyridin-3-yl]methylidene]hexanamide Openeye Name: (2E)-2-[[4-[4-(benzotriazol-1-yl)-1-piperidyl]-3-pyridyl]methylene]hexanamide CAS Name: (2E)-2-[[4-[4-(1-benzotriazolyl)-1-piperidinyl]-3-pyridinyl]methylidene]hexanamide IUPAC Name: (2E)-2-[[4-[4-(benzotriazol-1-yl)piperidin-1-yl]pyridin-3-yl]methylidene]hexanamide Traditional Name: (E)-3-[4-[4-(benzotriazol-1-yl)piperidino]-3-pyridyl]-2-butyl-acrylamide Formula: C23H28N6O MolecularWeight: 404.50802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=CC1=C(C=CN=C1)N2CCC(CC2)N3C4=CC=CC=C4N=N3)C(=O)N

Isomeric SMILES

CCCC/C(=C\C1=C(C=CN=C1)N2CCC(CC2)N3C4=CC=CC=C4N=N3)/C(=O)N

InChI

InChI=1S/C23H28N6O/c1-2-3-6-17(23(24)30)15-18-16-25-12-9-21(18)28-13-10-19(11-14-28)29-22-8-5-4-7-20(22)26-27-29/h4-5,7-9,12,15-16,19H,2-3,6,10-11,13-14H2,1H3,(H2,24,30)/b17-15+