3-ethyl-6-methyl-4-(3-methylsulfonylphenyl)-1,4-dihydropyridazine-5-carboxylic acid

Systemtic Name: 3-ethyl-6-methyl-4-(3-methylsulfonylphenyl)-1,4-dihydropyridazine-5-carboxylic acid Openeye Name: 3-ethyl-6-methyl-4-(3-methylsulfonylphenyl)-1,4-dihydropyridazine-5-carboxylic acid CAS Name: 3-ethyl-6-methyl-4-(3-methylsulfonylphenyl)-1,4-dihydropyridazine-5-carboxylic acid IUPAC Name: 3-ethyl-6-methyl-4-(3-methylsulfonylphenyl)-1,4-dihydropyridazine-5-carboxylic acid Traditional Name: 3-ethyl-4-(3-mesylphenyl)-6-methyl-1,4-dihydropyridazine-5-carboxylic acid Formula: C15H18N2O4S MolecularWeight: 322.37942

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NNC(=C(C1C2=CC(=CC=C2)S(=O)(=O)C)C(=O)O)C

Isomeric SMILES

CCC1=NNC(=C(C1C2=CC(=CC=C2)S(=O)(=O)C)C(=O)O)C

InChI

InChI=1S/C15H18N2O4S/c1-4-12-14(13(15(18)19)9(2)16-17-12)10-6-5-7-11(8-10)22(3,20)21/h5-8,14,16H,4H2,1-3H3,(H,18,19)