N-(6-ethoxy-1,3-benzothiazol-2-yl)-1-[(4-nitrophenyl)methyl]-2-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-1-[(4-nitrophenyl)methyl]-2-oxidanylidene-pyridine-3-carboxamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-1-[(4-nitrophenyl)methyl]-2-oxo-pyridine-3-carboxamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-1-[(4-nitrophenyl)methyl]-2-oxo-3-pyridinecarboxamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-1-[(4-nitrophenyl)methyl]-2-oxopyridine-3-carboxamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-keto-1-(4-nitrobenzyl)nicotinamide Formula: C22H18N4O5S MolecularWeight: 450.46712

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=CN(C3=O)CC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=CN(C3=O)CC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H18N4O5S/c1-2-31-16-9-10-18-19(12-16)32-22(23-18)24-20(27)17-4-3-11-25(21(17)28)13-14-5-7-15(8-6-14)26(29)30/h3-12H,2,13H2,1H3,(H,23,24,27)