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4-(4-chlorophenyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-pyridine-3-carboxylic acid

4-(4-chlorophenyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-pyridine-3-carboxylic acid

Systemtic Name:4-(4-chlorophenyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-pyridine-3-carboxylic acid
Openeye Name:4-(4-chlorophenyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-pyridine-3-carboxylic acid
CAS Name:4-(4-chlorophenyl)-2-[(4,6-dimethyl-2-pyrimidinyl)thio]-3-pyridinecarboxylic acid
IUPAC Name:4-(4-chlorophenyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanylpyridine-3-carboxylic acid
Traditional Name:4-(4-chlorophenyl)-2-[(4,6-dimethylpyrimidin-2-yl)thio]nicotinic acid
Formula: C18H14ClN3O2S
MolecularWeight: 371.84066
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2=NC=CC(=C2C(=O)O)C3=CC=C(C=C3)Cl)C


Isomeric SMILES

CC1=CC(=NC(=N1)SC2=NC=CC(=C2C(=O)O)C3=CC=C(C=C3)Cl)C


InChI

InChI=1S/C18H14ClN3O2S/c1-10-9-11(2)22-18(21-10)25-16-15(17(23)24)14(7-8-20-16)12-3-5-13(19)6-4-12/h3-9H,1-2H3,(H,23,24)


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