N'-(4-methylphenyl)carbonyl-4-(3-nitrophenyl)sulfonyl-piperazine-1-carbohydrazide

Systemtic Name: N'-(4-methylphenyl)carbonyl-4-(3-nitrophenyl)sulfonyl-piperazine-1-carbohydrazide Openeye Name: N'-(4-methylbenzoyl)-4-(3-nitrophenyl)sulfonyl-piperazine-1-carbohydrazide CAS Name: N'-[(4-methylphenyl)-oxomethyl]-4-(3-nitrophenyl)sulfonyl-1-piperazinecarbohydrazide IUPAC Name: N'-(4-methylbenzoyl)-4-(3-nitrophenyl)sulfonylpiperazine-1-carbohydrazide Traditional Name: 4-(3-nitrophenyl)sulfonyl-N'-p-toluoyl-piperazine-1-carbohydrazide Formula: C19H21N5O6S MolecularWeight: 447.46494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NNC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NNC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N5O6S/c1-14-5-7-15(8-6-14)18(25)20-21-19(26)22-9-11-23(12-10-22)31(29,30)17-4-2-3-16(13-17)24(27)28/h2-8,13H,9-12H2,1H3,(H,20,25)(H,21,26)