2-cyclopropyl-4-methyl-6-(pyridin-3-ylmethylsulfanyl)pyrimidine-5-carboxylic acid

Systemtic Name: 2-cyclopropyl-4-methyl-6-(pyridin-3-ylmethylsulfanyl)pyrimidine-5-carboxylic acid Openeye Name: 2-cyclopropyl-4-methyl-6-(3-pyridylmethylsulfanyl)pyrimidine-5-carboxylic acid CAS Name: 2-cyclopropyl-4-methyl-6-(3-pyridinylmethylthio)-5-pyrimidinecarboxylic acid IUPAC Name: 2-cyclopropyl-4-methyl-6-(pyridin-3-ylmethylsulfanyl)pyrimidine-5-carboxylic acid Traditional Name: 2-cyclopropyl-4-methyl-6-(3-pyridylmethylthio)pyrimidine-5-carboxylic acid Formula: C15H15N3O2S MolecularWeight: 301.3635

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2CC2)SCC3=CN=CC=C3)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=N1)C2CC2)SCC3=CN=CC=C3)C(=O)O

InChI

InChI=1S/C15H15N3O2S/c1-9-12(15(19)20)14(18-13(17-9)11-4-5-11)21-8-10-3-2-6-16-7-10/h2-3,6-7,11H,4-5,8H2,1H3,(H,19,20)