(5-nitro-1-benzothiophen-2-yl)-(4-pyridin-3-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: (5-nitro-1-benzothiophen-2-yl)-(4-pyridin-3-ylsulfonylpiperazin-1-yl)methanone Openeye Name: (5-nitrobenzothiophen-2-yl)-[4-(3-pyridylsulfonyl)piperazin-1-yl]methanone CAS Name: (5-nitro-1-benzothiophen-2-yl)-[4-(3-pyridinylsulfonyl)-1-piperazinyl]methanone IUPAC Name: (5-nitro-1-benzothiophen-2-yl)-(4-pyridin-3-ylsulfonylpiperazin-1-yl)methanone Traditional Name: (5-nitrobenzothiophen-2-yl)-[4-(3-pyridylsulfonyl)piperazino]methanone Formula: C18H16N4O5S2 MolecularWeight: 432.47344

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])S(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])S(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C18H16N4O5S2/c23-18(17-11-13-10-14(22(24)25)3-4-16(13)28-17)20-6-8-21(9-7-20)29(26,27)15-2-1-5-19-12-15/h1-5,10-12H,6-9H2