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

Systemtic Name: [4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(2-methyl-5-nitro-pyridin-3-yl)methanone Openeye Name: [4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(2-methyl-5-nitro-3-pyridyl)methanone CAS Name: [4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-(2-methyl-5-nitro-3-pyridinyl)methanone IUPAC Name: [4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(2-methyl-5-nitropyridin-3-yl)methanone Traditional Name: [4-(4-chlorophenyl)sulfonylpiperazino]-(2-methyl-5-nitro-3-pyridyl)methanone Formula: C17H17ClN4O5S MolecularWeight: 424.85868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(C=C1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H17ClN4O5S/c1-12-16(10-14(11-19-12)22(24)25)17(23)20-6-8-21(9-7-20)28(26,27)15-4-2-13(18)3-5-15/h2-5,10-11H,6-9H2,1H3