3-(4-methylpiperazin-1-yl)-N-(3-nitrocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-oxidanylidene-propanamide

Systemtic Name: 3-(4-methylpiperazin-1-yl)-N-(3-nitrocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-oxidanylidene-propanamide Openeye Name: 3-(4-methylpiperazin-1-yl)-N-(3-nitrocarbonyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-oxo-propanamide CAS Name: 3-(4-methyl-1-piperazinyl)-N-[3-[nitro(oxo)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-oxopropanamide IUPAC Name: 3-(4-methylpiperazin-1-yl)-N-(3-nitrocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-oxopropanamide Traditional Name: 3-keto-3-(4-methylpiperazino)-N-(3-nitrocarbonyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)propionamide Formula: C17H22N4O5S MolecularWeight: 394.44538

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)CC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C(=O)CC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)[N+](=O)[O-]

InChI

InChI=1S/C17H22N4O5S/c1-19-6-8-20(9-7-19)14(23)10-13(22)18-16-15(17(24)21(25)26)11-4-2-3-5-12(11)27-16/h2-10H2,1H3,(H,18,22)