6-azanyl-4-(2-chlorophenyl)-2-methyl-5-methylsulfanyl-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 6-azanyl-4-(2-chlorophenyl)-2-methyl-5-methylsulfanyl-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 6-amino-4-(2-chlorophenyl)-2-methyl-5-methylsulfanyl-1,4-dihydropyridine-3-carboxylic acid CAS Name: 6-amino-4-(2-chlorophenyl)-2-methyl-5-(methylthio)-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 6-amino-4-(2-chlorophenyl)-2-methyl-5-methylsulfanyl-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 6-amino-4-(2-chlorophenyl)-2-methyl-5-(methylthio)-1,4-dihydropyridine-3-carboxylic acid Formula: C14H15ClN2O2S MolecularWeight: 310.7991

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)N)SC)C2=CC=CC=C2Cl)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)N)SC)C2=CC=CC=C2Cl)C(=O)O

InChI

InChI=1S/C14H15ClN2O2S/c1-7-10(14(18)19)11(12(20-2)13(16)17-7)8-5-3-4-6-9(8)15/h3-6,11,17H,16H2,1-2H3,(H,18,19)