N-[(2-methoxyphenyl)methyl]-2-[6-(4-nitrophenyl)pyridazin-3-yl]sulfanyl-ethanamide

Systemtic Name: N-[(2-methoxyphenyl)methyl]-2-[6-(4-nitrophenyl)pyridazin-3-yl]sulfanyl-ethanamide Openeye Name: N-[(2-methoxyphenyl)methyl]-2-[6-(4-nitrophenyl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-[(2-methoxyphenyl)methyl]-2-[[6-(4-nitrophenyl)-3-pyridazinyl]thio]acetamide IUPAC Name: N-[(2-methoxyphenyl)methyl]-2-[6-(4-nitrophenyl)pyridazin-3-yl]sulfanylacetamide Traditional Name: 2-[[6-(4-nitrophenyl)pyridazin-3-yl]thio]-N-o-anisyl-acetamide Formula: C20H18N4O4S MolecularWeight: 410.44632

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC(=O)CSC2=NN=C(C=C2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1CNC(=O)CSC2=NN=C(C=C2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O4S/c1-28-18-5-3-2-4-15(18)12-21-19(25)13-29-20-11-10-17(22-23-20)14-6-8-16(9-7-14)24(26)27/h2-11H,12-13H2,1H3,(H,21,25)