N,6-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-1-(2-nitrophenyl)-4-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: N,6-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-1-(2-nitrophenyl)-4-oxidanylidene-pyridazine-3-carboxamide Openeye Name: N,6-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-1-(2-nitrophenyl)-4-oxo-pyridazine-3-carboxamide CAS Name: N,6-dimethyl-N-[[4-(methylthio)phenyl]methyl]-1-(2-nitrophenyl)-4-oxo-3-pyridazinecarboxamide IUPAC Name: N,6-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-1-(2-nitrophenyl)-4-oxopyridazine-3-carboxamide Traditional Name: 4-keto-N,6-dimethyl-N-[4-(methylthio)benzyl]-1-(2-nitrophenyl)pyridazine-3-carboxamide Formula: C21H20N4O4S MolecularWeight: 424.4729

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2[N+](=O)[O-])C(=O)N(C)CC3=CC=C(C=C3)SC

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2[N+](=O)[O-])C(=O)N(C)CC3=CC=C(C=C3)SC

InChI

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