4-(3-chlorophenyl)-2,6-dimethyl-5-propan-2-ylsulfinyl-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 4-(3-chlorophenyl)-2,6-dimethyl-5-propan-2-ylsulfinyl-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 4-(3-chlorophenyl)-5-isopropylsulfinyl-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid CAS Name: 4-(3-chlorophenyl)-2,6-dimethyl-5-propan-2-ylsulfinyl-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 4-(3-chlorophenyl)-2,6-dimethyl-5-propan-2-ylsulfinyl-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 4-(3-chlorophenyl)-5-isopropylsulfinyl-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid Formula: C17H20ClNO3S MolecularWeight: 353.8636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)S(=O)C(C)C)C2=CC(=CC=C2)Cl)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)C)S(=O)C(C)C)C2=CC(=CC=C2)Cl)C(=O)O

InChI

InChI=1S/C17H20ClNO3S/c1-9(2)23(22)16-11(4)19-10(3)14(17(20)21)15(16)12-6-5-7-13(18)8-12/h5-9,15,19H,1-4H3,(H,20,21)