4-cyclopentylsulfanyl-2-cyclopropyl-6-methyl-pyrimidine-5-carboxylic acid

Systemtic Name: 4-cyclopentylsulfanyl-2-cyclopropyl-6-methyl-pyrimidine-5-carboxylic acid Openeye Name: 4-cyclopentylsulfanyl-2-cyclopropyl-6-methyl-pyrimidine-5-carboxylic acid CAS Name: 4-(cyclopentylthio)-2-cyclopropyl-6-methyl-5-pyrimidinecarboxylic acid IUPAC Name: 4-cyclopentylsulfanyl-2-cyclopropyl-6-methylpyrimidine-5-carboxylic acid Traditional Name: 4-(cyclopentylthio)-2-cyclopropyl-6-methyl-pyrimidine-5-carboxylic acid Formula: C14H18N2O2S MolecularWeight: 278.36992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2CC2)SC3CCCC3)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=N1)C2CC2)SC3CCCC3)C(=O)O

InChI

InChI=1S/C14H18N2O2S/c1-8-11(14(17)18)13(19-10-4-2-3-5-10)16-12(15-8)9-6-7-9/h9-10H,2-7H2,1H3,(H,17,18)