4-[2,3-bis(chloranyl)phenyl]-2,6-dimethyl-5-propan-2-ylsulfanyl-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 4-[2,3-bis(chloranyl)phenyl]-2,6-dimethyl-5-propan-2-ylsulfanyl-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 4-(2,3-dichlorophenyl)-5-isopropylsulfanyl-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid CAS Name: 4-(2,3-dichlorophenyl)-2,6-dimethyl-5-(propan-2-ylthio)-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 4-(2,3-dichlorophenyl)-2,6-dimethyl-5-propan-2-ylsulfanyl-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 4-(2,3-dichlorophenyl)-5-(isopropylthio)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid Formula: C17H19Cl2NO2S MolecularWeight: 372.30926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19Cl2NO2S/c1-8(2)23-16-10(4)20-9(3)13(17(21)22)14(16)11-6-5-7-12(18)15(11)19/h5-8,14,20H,1-4H3,(H,21,22)