1H-indazol-3-yl-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]methanone

Systemtic Name: 1H-indazol-3-yl-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]methanone Openeye Name: 1H-indazol-3-yl-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]methanone CAS Name: 1H-indazol-3-yl-[4-(4-methylsulfonyl-2-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: 1H-indazol-3-yl-[4-(4-methylsulfonyl-2-nitrophenyl)piperazin-1-yl]methanone Traditional Name: 1H-indazol-3-yl-[4-(4-mesyl-2-nitro-phenyl)piperazino]methanone Formula: C19H19N5O5S MolecularWeight: 429.44966

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=NNC4=CC=CC=C43)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=NNC4=CC=CC=C43)[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O5S/c1-30(28,29)13-6-7-16(17(12-13)24(26)27)22-8-10-23(11-9-22)19(25)18-14-4-2-3-5-15(14)20-21-18/h2-7,12H,8-11H2,1H3,(H,20,21)