1-(3,4-dimethylphenyl)-5-methyl-N-(2-oxidanylidenechromen-6-yl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-(3,4-dimethylphenyl)-5-methyl-N-(2-oxidanylidenechromen-6-yl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-(3,4-dimethylphenyl)-5-methyl-N-(2-oxochromen-6-yl)triazole-4-carboxamide CAS Name: 1-(3,4-dimethylphenyl)-5-methyl-N-(2-oxo-1-benzopyran-6-yl)-4-triazolecarboxamide IUPAC Name: 1-(3,4-dimethylphenyl)-5-methyl-N-(2-oxochromen-6-yl)triazole-4-carboxamide Traditional Name: 1-(3,4-dimethylphenyl)-N-(2-ketochromen-6-yl)-5-methyl-triazole-4-carboxamide Formula: C21H18N4O3 MolecularWeight: 374.39262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=C(N=N2)C(=O)NC3=CC4=C(C=C3)OC(=O)C=C4)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=C(N=N2)C(=O)NC3=CC4=C(C=C3)OC(=O)C=C4)C)C

InChI

InChI=1S/C21H18N4O3/c1-12-4-7-17(10-13(12)2)25-14(3)20(23-24-25)21(27)22-16-6-8-18-15(11-16)5-9-19(26)28-18/h4-11H,1-3H3,(H,22,27)