2-[3-[4-(6-nitropyridin-3-yl)piperazin-1-yl]propanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[3-[4-(6-nitropyridin-3-yl)piperazin-1-yl]propanoylamino]thiophene-3-carboxamide Openeye Name: 2-[3-[4-(6-nitro-3-pyridyl)piperazin-1-yl]propanoylamino]thiophene-3-carboxamide CAS Name: 2-[[3-[4-(6-nitro-3-pyridinyl)-1-piperazinyl]-1-oxopropyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[3-[4-(6-nitropyridin-3-yl)piperazin-1-yl]propanoylamino]thiophene-3-carboxamide Traditional Name: 2-[3-[4-(6-nitro-3-pyridyl)piperazino]propanoylamino]thiophene-3-carboxamide Formula: C17H20N6O4S MolecularWeight: 404.4435

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)NC2=C(C=CS2)C(=O)N)C3=CN=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CCC(=O)NC2=C(C=CS2)C(=O)N)C3=CN=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H20N6O4S/c18-16(25)13-4-10-28-17(13)20-15(24)3-5-21-6-8-22(9-7-21)12-1-2-14(19-11-12)23(26)27/h1-2,4,10-11H,3,5-9H2,(H2,18,25)(H,20,24)