4-nitro-N-[3-oxidanylidene-3-(4-thiophen-2-ylsulfonylpiperazin-1-yl)propyl]benzamide

Systemtic Name: 4-nitro-N-[3-oxidanylidene-3-(4-thiophen-2-ylsulfonylpiperazin-1-yl)propyl]benzamide Openeye Name: 4-nitro-N-[3-oxo-3-[4-(2-thienylsulfonyl)piperazin-1-yl]propyl]benzamide CAS Name: 4-nitro-N-[3-oxo-3-(4-thiophen-2-ylsulfonyl-1-piperazinyl)propyl]benzamide IUPAC Name: 4-nitro-N-[3-oxo-3-(4-thiophen-2-ylsulfonylpiperazin-1-yl)propyl]benzamide Traditional Name: N-[3-keto-3-[4-(2-thienylsulfonyl)piperazino]propyl]-4-nitro-benzamide Formula: C18H20N4O6S2 MolecularWeight: 452.5046

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CCN1C(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C18H20N4O6S2/c23-16(7-8-19-18(24)14-3-5-15(6-4-14)22(25)26)20-9-11-21(12-10-20)30(27,28)17-2-1-13-29-17/h1-6,13H,7-12H2,(H,19,24)