1-[5-[[4-(diethylamino)phenyl]methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-2-phenoxy-ethanone

Systemtic Name: 1-[5-[[4-(diethylamino)phenyl]methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-2-phenoxy-ethanone Openeye Name: 1-[5-[[4-(diethylamino)phenyl]methylamino]-3-(3-pyridyl)-1,2,4-triazol-1-yl]-2-phenoxy-ethanone CAS Name: 1-[5-[[4-(diethylamino)phenyl]methylamino]-3-(3-pyridinyl)-1,2,4-triazol-1-yl]-2-phenoxyethanone IUPAC Name: 1-[5-[[4-(diethylamino)phenyl]methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-2-phenoxyethanone Traditional Name: 1-[5-[[4-(diethylamino)benzyl]amino]-3-(3-pyridyl)-1,2,4-triazol-1-yl]-2-phenoxy-ethanone Formula: C26H28N6O2 MolecularWeight: 456.53952

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)CNC2=NC(=NN2C(=O)COC3=CC=CC=C3)C4=CN=CC=C4

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)CNC2=NC(=NN2C(=O)COC3=CC=CC=C3)C4=CN=CC=C4

InChI

InChI=1S/C26H28N6O2/c1-3-31(4-2)22-14-12-20(13-15-22)17-28-26-29-25(21-9-8-16-27-18-21)30-32(26)24(33)19-34-23-10-6-5-7-11-23/h5-16,18H,3-4,17,19H2,1-2H3,(H,28,29,30)