N5-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide

Systemtic Name: N5-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide Openeye Name: N5-[2-(2-ethylanilino)-2-oxo-ethyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide CAS Name: N5-[2-(2-ethylanilino)-2-oxoethyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide IUPAC Name: 5-N-[2-(2-ethylanilino)-2-oxoethyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide Traditional Name: N-[2-(2-ethylanilino)-2-keto-ethyl]-1-phenyl-2-pyrazoline-3,5-dicarboxamide Formula: C21H23N5O3 MolecularWeight: 393.43902

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CNC(=O)C2=NN(C(C2)C(=O)N)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CNC(=O)C2=NN(C(C2)C(=O)N)C3=CC=CC=C3

InChI

InChI=1S/C21H23N5O3/c1-2-14-8-6-7-11-16(14)24-19(27)13-23-21(29)17-12-18(20(22)28)26(25-17)15-9-4-3-5-10-15/h3-11,18H,2,12-13H2,1H3,(H2,22,28)(H,23,29)(H,24,27)