N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1,4-bis(phenylsulfonyl)piperazine-2-carboxamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1,4-bis(phenylsulfonyl)piperazine-2-carboxamide Openeye Name: 1,4-bis(benzenesulfonyl)-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)piperazine-2-carboxamide CAS Name: 1,4-bis(benzenesulfonyl)-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-piperazinecarboxamide IUPAC Name: 1,4-bis(benzenesulfonyl)-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)piperazine-2-carboxamide Traditional Name: 1,4-dibesyl-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)piperazine-2-carboxamide Formula: C28H29N5O6S2 MolecularWeight: 595.68976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3CN(CCN3S(=O)(=O)C4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3CN(CCN3S(=O)(=O)C4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H29N5O6S2/c1-21-26(28(35)33(30(21)2)22-12-6-3-7-13-22)29-27(34)25-20-31(40(36,37)23-14-8-4-9-15-23)18-19-32(25)41(38,39)24-16-10-5-11-17-24/h3-17,25H,18-20H2,1-2H3,(H,29,34)