4-[2-[(2-ethoxypyridin-3-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-3-nitro-benzamide

Systemtic Name: 4-[2-[(2-ethoxypyridin-3-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-3-nitro-benzamide Openeye Name: 4-[2-[(2-ethoxy-3-pyridyl)amino]-2-oxo-ethyl]sulfanyl-3-nitro-benzamide CAS Name: 4-[[2-[(2-ethoxy-3-pyridinyl)amino]-2-oxoethyl]thio]-3-nitrobenzamide IUPAC Name: 4-[2-[(2-ethoxypyridin-3-yl)amino]-2-oxoethyl]sulfanyl-3-nitrobenzamide Traditional Name: 4-[[2-[(2-ethoxy-3-pyridyl)amino]-2-keto-ethyl]thio]-3-nitro-benzamide Formula: C16H16N4O5S MolecularWeight: 376.38704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=N1)NC(=O)CSC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=CC=N1)NC(=O)CSC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H16N4O5S/c1-2-25-16-11(4-3-7-18-16)19-14(21)9-26-13-6-5-10(15(17)22)8-12(13)20(23)24/h3-8H,2,9H2,1H3,(H2,17,22)(H,19,21)