1-[5-[[4-(diethylamino)phenyl]methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-3-methyl-butan-1-one

Systemtic Name: 1-[5-[[4-(diethylamino)phenyl]methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[5-[[4-(diethylamino)phenyl]methylamino]-3-(3-pyridyl)-1,2,4-triazol-1-yl]-3-methyl-butan-1-one CAS Name: 1-[5-[[4-(diethylamino)phenyl]methylamino]-3-(3-pyridinyl)-1,2,4-triazol-1-yl]-3-methyl-1-butanone IUPAC Name: 1-[5-[[4-(diethylamino)phenyl]methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-3-methylbutan-1-one Traditional Name: 1-[5-[[4-(diethylamino)benzyl]amino]-3-(3-pyridyl)-1,2,4-triazol-1-yl]-3-methyl-butan-1-one Formula: C23H30N6O MolecularWeight: 406.5239

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N6O/c1-5-28(6-2)20-11-9-18(10-12-20)15-25-23-26-22(19-8-7-13-24-16-19)27-29(23)21(30)14-17(3)4/h7-13,16-17H,5-6,14-15H2,1-4H3,(H,25,26,27)