6-(3,4-dimethylphenyl)-2-phenyl-5-sulfanyl-4,5-dihydropyridazin-3-one

Systemtic Name: 6-(3,4-dimethylphenyl)-2-phenyl-5-sulfanyl-4,5-dihydropyridazin-3-one Openeye Name: 6-(3,4-dimethylphenyl)-2-phenyl-5-sulfanyl-4,5-dihydropyridazin-3-one CAS Name: 6-(3,4-dimethylphenyl)-5-mercapto-2-phenyl-4,5-dihydropyridazin-3-one IUPAC Name: 6-(3,4-dimethylphenyl)-2-phenyl-5-sulfanyl-4,5-dihydropyridazin-3-one Traditional Name: 6-(3,4-dimethylphenyl)-5-mercapto-2-phenyl-4,5-dihydropyridazin-3-one Formula: C18H18N2OS MolecularWeight: 310.41332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C(=O)CC2S)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=O)CC2S)C3=CC=CC=C3)C

InChI

InChI=1S/C18H18N2OS/c1-12-8-9-14(10-13(12)2)18-16(22)11-17(21)20(19-18)15-6-4-3-5-7-15/h3-10,16,22H,11H2,1-2H3