3-(4-acetamidophenyl)-N-(3,4-dicyanophenyl)-5-methyl-1,4-dihydropyrazole-5-carboxamide

Systemtic Name: 3-(4-acetamidophenyl)-N-(3,4-dicyanophenyl)-5-methyl-1,4-dihydropyrazole-5-carboxamide Openeye Name: 3-(4-acetamidophenyl)-N-(3,4-dicyanophenyl)-5-methyl-1,4-dihydropyrazole-5-carboxamide CAS Name: 3-(4-acetamidophenyl)-N-(3,4-dicyanophenyl)-5-methyl-1,4-dihydropyrazole-5-carboxamide IUPAC Name: 3-(4-acetamidophenyl)-N-(3,4-dicyanophenyl)-5-methyl-1,4-dihydropyrazole-5-carboxamide Traditional Name: 5-(4-acetamidophenyl)-N-(3,4-dicyanophenyl)-3-methyl-2-pyrazoline-3-carboxamide Formula: C21H18N6O2 MolecularWeight: 386.40662

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C2=NNC(C2)(C)C(=O)NC3=CC(=C(C=C3)C#N)C#N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C2=NNC(C2)(C)C(=O)NC3=CC(=C(C=C3)C#N)C#N

InChI

InChI=1S/C21H18N6O2/c1-13(28)24-17-6-3-14(4-7-17)19-10-21(2,27-26-19)20(29)25-18-8-5-15(11-22)16(9-18)12-23/h3-9,27H,10H2,1-2H3,(H,24,28)(H,25,29)