4-(3-chlorophenyl)-6-methyl-2-pyridin-3-yl-1,4-dihydropyrimidine-5-carboxylic acid

Systemtic Name: 4-(3-chlorophenyl)-6-methyl-2-pyridin-3-yl-1,4-dihydropyrimidine-5-carboxylic acid Openeye Name: 4-(3-chlorophenyl)-6-methyl-2-(3-pyridyl)-1,4-dihydropyrimidine-5-carboxylic acid CAS Name: 4-(3-chlorophenyl)-6-methyl-2-(3-pyridinyl)-1,4-dihydropyrimidine-5-carboxylic acid IUPAC Name: 4-(3-chlorophenyl)-6-methyl-2-pyridin-3-yl-1,4-dihydropyrimidine-5-carboxylic acid Traditional Name: 4-(3-chlorophenyl)-6-methyl-2-(3-pyridyl)-1,4-dihydropyrimidine-5-carboxylic acid Formula: C17H14ClN3O2 MolecularWeight: 327.76496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N=C(N1)C2=CN=CC=C2)C3=CC(=CC=C3)Cl)C(=O)O

Isomeric SMILES

CC1=C(C(N=C(N1)C2=CN=CC=C2)C3=CC(=CC=C3)Cl)C(=O)O

InChI

InChI=1S/C17H14ClN3O2/c1-10-14(17(22)23)15(11-4-2-6-13(18)8-11)21-16(20-10)12-5-3-7-19-9-12/h2-9,15H,1H3,(H,20,21)(H,22,23)