[(E)-[(4-nitrophenyl)-pyridin-4-yl-methylidene]amino] 2-methylsulfanylbenzoate

Systemtic Name: [(E)-[(4-nitrophenyl)-pyridin-4-yl-methylidene]amino] 2-methylsulfanylbenzoate Openeye Name: [(E)-[(4-nitrophenyl)-(4-pyridyl)methylene]amino] 2-methylsulfanylbenzoate CAS Name: 2-(methylthio)benzoic acid [(E)-[(4-nitrophenyl)-pyridin-4-ylmethylidene]amino] ester IUPAC Name: [(E)-[(4-nitrophenyl)-pyridin-4-ylmethylidene]amino] 2-methylsulfanylbenzoate Traditional Name: 2-(methylthio)benzoic acid [(E)-[(4-nitrophenyl)-(4-pyridyl)methylene]amino] ester Formula: C20H15N3O4S MolecularWeight: 393.4158

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)ON=C(C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=NC=C3

Isomeric SMILES

CSC1=CC=CC=C1C(=O)O/N=C(\C2=CC=C(C=C2)[N+](=O)[O-])/C3=CC=NC=C3

InChI

InChI=1S/C20H15N3O4S/c1-28-18-5-3-2-4-17(18)20(24)27-22-19(15-10-12-21-13-11-15)14-6-8-16(9-7-14)23(25)26/h2-13H,1H3/b22-19+