5-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]carbonyl-2-phenyl-3,4-dihydropyrazole-3-carboxamide

Systemtic Name: 5-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]carbonyl-2-phenyl-3,4-dihydropyrazole-3-carboxamide Openeye Name: 5-[4-(2-nitrophenyl)sulfonylpiperazine-1-carbonyl]-2-phenyl-3,4-dihydropyrazole-3-carboxamide CAS Name: 5-[[4-(2-nitrophenyl)sulfonyl-1-piperazinyl]-oxomethyl]-2-phenyl-3,4-dihydropyrazole-3-carboxamide IUPAC Name: 5-[4-(2-nitrophenyl)sulfonylpiperazine-1-carbonyl]-2-phenyl-3,4-dihydropyrazole-3-carboxamide Traditional Name: 5-[4-(2-nitrophenyl)sulfonylpiperazine-1-carbonyl]-2-phenyl-2-pyrazoline-3-carboxamide Formula: C21H22N6O6S MolecularWeight: 486.50098

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=NN(C(C2)C(=O)N)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)C2=NN(C(C2)C(=O)N)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H22N6O6S/c22-20(28)18-14-16(23-26(18)15-6-2-1-3-7-15)21(29)24-10-12-25(13-11-24)34(32,33)19-9-5-4-8-17(19)27(30)31/h1-9,18H,10-14H2,(H2,22,28)