3-nitro-N-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]benzamide

Systemtic Name: 3-nitro-N-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]benzamide Openeye Name: 3-nitro-N-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]benzamide CAS Name: 3-nitro-N-[2-oxo-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]ethyl]benzamide IUPAC Name: 3-nitro-N-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]benzamide Traditional Name: N-[2-keto-2-[4-(2-thenoyl)piperazino]ethyl]-3-nitro-benzamide Formula: C18H18N4O5S MolecularWeight: 402.42432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4O5S/c23-16(12-19-17(24)13-3-1-4-14(11-13)22(26)27)20-6-8-21(9-7-20)18(25)15-5-2-10-28-15/h1-5,10-11H,6-9,12H2,(H,19,24)