(5-cyclopropyl-1H-pyrazol-3-yl)-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (5-cyclopropyl-1H-pyrazol-3-yl)-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (5-cyclopropyl-1H-pyrazol-3-yl)-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (5-cyclopropyl-1H-pyrazol-3-yl)-[4-(2-nitrophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (5-cyclopropyl-1H-pyrazol-3-yl)-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (5-cyclopropyl-1H-pyrazol-3-yl)-[4-(2-nitrophenyl)sulfonylpiperazino]methanone Formula: C17H19N5O5S MolecularWeight: 405.42826

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC(=NN2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CC1C2=CC(=NN2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C17H19N5O5S/c23-17(14-11-13(18-19-14)12-5-6-12)20-7-9-21(10-8-20)28(26,27)16-4-2-1-3-15(16)22(24)25/h1-4,11-12H,5-10H2,(H,18,19)