1-[5-[(3,4-dimethoxyphenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-2-methyl-propan-1-one

Systemtic Name: 1-[5-[(3,4-dimethoxyphenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-2-methyl-propan-1-one Openeye Name: 1-[5-[(3,4-dimethoxyphenyl)methylamino]-3-(3-pyridyl)-1,2,4-triazol-1-yl]-2-methyl-propan-1-one CAS Name: 1-[5-[(3,4-dimethoxyphenyl)methylamino]-3-(3-pyridinyl)-1,2,4-triazol-1-yl]-2-methyl-1-propanone IUPAC Name: 1-[5-[(3,4-dimethoxyphenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-2-methylpropan-1-one Traditional Name: 2-methyl-1-[3-(3-pyridyl)-5-(veratrylamino)-1,2,4-triazol-1-yl]propan-1-one Formula: C20H23N5O3 MolecularWeight: 381.42832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1C(=NC(=N1)C2=CN=CC=C2)NCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(C)C(=O)N1C(=NC(=N1)C2=CN=CC=C2)NCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H23N5O3/c1-13(2)19(26)25-20(23-18(24-25)15-6-5-9-21-12-15)22-11-14-7-8-16(27-3)17(10-14)28-4/h5-10,12-13H,11H2,1-4H3,(H,22,23,24)