N-[5-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-3-yl]-3-methyl-benzamide

Systemtic Name: N-[5-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-3-yl]-3-methyl-benzamide Openeye Name: N-[5-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-3-yl]-3-methyl-benzamide CAS Name: N-[5-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-3-yl]-3-methylbenzamide IUPAC Name: N-[5-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-3-yl]-3-methylbenzamide Traditional Name: N-[5-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-3-yl]-3-methyl-benzamide Formula: C18H18N4O3 MolecularWeight: 338.36052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=NNC(=N2)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=NNC(=N2)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C18H18N4O3/c1-11-5-4-6-13(9-11)17(23)20-18-19-16(21-22-18)12-7-8-14(24-2)15(10-12)25-3/h4-10H,1-3H3,(H2,19,20,21,22,23)