N-[2-(diethylamino)-2-thiophen-3-yl-ethyl]-2-methyl-5-nitro-pyridine-3-carboxamide

Systemtic Name: N-[2-(diethylamino)-2-thiophen-3-yl-ethyl]-2-methyl-5-nitro-pyridine-3-carboxamide Openeye Name: N-[2-(diethylamino)-2-(3-thienyl)ethyl]-2-methyl-5-nitro-pyridine-3-carboxamide CAS Name: N-[2-(diethylamino)-2-(3-thiophenyl)ethyl]-2-methyl-5-nitro-3-pyridinecarboxamide IUPAC Name: N-[2-(diethylamino)-2-thiophen-3-ylethyl]-2-methyl-5-nitropyridine-3-carboxamide Traditional Name: N-[2-(diethylamino)-2-(3-thienyl)ethyl]-2-methyl-5-nitro-nicotinamide Formula: C17H22N4O3S MolecularWeight: 362.44658

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CNC(=O)C1=CC(=CN=C1C)[N+](=O)[O-])C2=CSC=C2

Isomeric SMILES

CCN(CC)C(CNC(=O)C1=CC(=CN=C1C)[N+](=O)[O-])C2=CSC=C2

InChI

InChI=1S/C17H22N4O3S/c1-4-20(5-2)16(13-6-7-25-11-13)10-19-17(22)15-8-14(21(23)24)9-18-12(15)3/h6-9,11,16H,4-5,10H2,1-3H3,(H,19,22)