N-[4-[4-(5-nitrothiophen-2-yl)carbonylpiperazin-1-yl]-4-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: N-[4-[4-(5-nitrothiophen-2-yl)carbonylpiperazin-1-yl]-4-oxidanylidene-butan-2-yl]benzamide Openeye Name: N-[1-methyl-3-[4-(5-nitrothiophene-2-carbonyl)piperazin-1-yl]-3-oxo-propyl]benzamide CAS Name: N-[4-[4-[(5-nitro-2-thiophenyl)-oxomethyl]-1-piperazinyl]-4-oxobutan-2-yl]benzamide IUPAC Name: N-[4-[4-(5-nitrothiophene-2-carbonyl)piperazin-1-yl]-4-oxobutan-2-yl]benzamide Traditional Name: N-[3-keto-1-methyl-3-[4-(5-nitrothiophene-2-carbonyl)piperazino]propyl]benzamide Formula: C20H22N4O5S MolecularWeight: 430.47748

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)N1CCN(CC1)C(=O)C2=CC=C(S2)[N+](=O)[O-])NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(CC(=O)N1CCN(CC1)C(=O)C2=CC=C(S2)[N+](=O)[O-])NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H22N4O5S/c1-14(21-19(26)15-5-3-2-4-6-15)13-17(25)22-9-11-23(12-10-22)20(27)16-7-8-18(30-16)24(28)29/h2-8,14H,9-13H2,1H3,(H,21,26)