4-ethyl-5-methyl-2-[(2-nitrophenyl)carbonylamino]-N-(pyridin-3-ylmethyl)thiophene-3-carboxamide

Systemtic Name: 4-ethyl-5-methyl-2-[(2-nitrophenyl)carbonylamino]-N-(pyridin-3-ylmethyl)thiophene-3-carboxamide Openeye Name: 4-ethyl-5-methyl-2-[(2-nitrobenzoyl)amino]-N-(3-pyridylmethyl)thiophene-3-carboxamide CAS Name: 4-ethyl-5-methyl-2-[[(2-nitrophenyl)-oxomethyl]amino]-N-(3-pyridinylmethyl)-3-thiophenecarboxamide IUPAC Name: 4-ethyl-5-methyl-2-[(2-nitrobenzoyl)amino]-N-(pyridin-3-ylmethyl)thiophene-3-carboxamide Traditional Name: 4-ethyl-5-methyl-2-[(2-nitrobenzoyl)amino]-N-(3-pyridylmethyl)thiophene-3-carboxamide Formula: C21H20N4O4S MolecularWeight: 424.4729

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)NCC2=CN=CC=C2)NC(=O)C3=CC=CC=C3[N+](=O)[O-])C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)NCC2=CN=CC=C2)NC(=O)C3=CC=CC=C3[N+](=O)[O-])C

InChI

InChI=1S/C21H20N4O4S/c1-3-15-13(2)30-21(18(15)20(27)23-12-14-7-6-10-22-11-14)24-19(26)16-8-4-5-9-17(16)25(28)29/h4-11H,3,12H2,1-2H3,(H,23,27)(H,24,26)