[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-pyridin-3-yl-methanone

Systemtic Name: [4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-pyridin-3-yl-methanone Openeye Name: [4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-(3-pyridyl)methanone CAS Name: [4-(2-methyl-5-nitrophenyl)sulfonyl-1-piperazinyl]-(3-pyridinyl)methanone IUPAC Name: [4-(2-methyl-5-nitrophenyl)sulfonylpiperazin-1-yl]-pyridin-3-ylmethanone Traditional Name: [4-(2-methyl-5-nitro-phenyl)sulfonylpiperazino]-(3-pyridyl)methanone Formula: C17H18N4O5S MolecularWeight: 390.41362

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N4O5S/c1-13-4-5-15(21(23)24)11-16(13)27(25,26)20-9-7-19(8-10-20)17(22)14-3-2-6-18-12-14/h2-6,11-12H,7-10H2,1H3