3-nitro-4-[[4-(thiophen-2-ylmethyl)piperazin-1-yl]methyl]benzamide

Systemtic Name: 3-nitro-4-[[4-(thiophen-2-ylmethyl)piperazin-1-yl]methyl]benzamide Openeye Name: 3-nitro-4-[[4-(2-thienylmethyl)piperazin-1-yl]methyl]benzamide CAS Name: 3-nitro-4-[[4-(thiophen-2-ylmethyl)-1-piperazinyl]methyl]benzamide IUPAC Name: 3-nitro-4-[[4-(thiophen-2-ylmethyl)piperazin-1-yl]methyl]benzamide Traditional Name: 3-nitro-4-[[4-(2-thenyl)piperazino]methyl]benzamide Formula: C17H20N4O3S MolecularWeight: 360.4307

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])CC3=CC=CS3

Isomeric SMILES

C1CN(CCN1CC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])CC3=CC=CS3

InChI

InChI=1S/C17H20N4O3S/c18-17(22)13-3-4-14(16(10-13)21(23)24)11-19-5-7-20(8-6-19)12-15-2-1-9-25-15/h1-4,9-10H,5-8,11-12H2,(H2,18,22)