2-cyclopropyl-4-methyl-6-[(5-methylfuran-2-yl)methylsulfanyl]pyrimidine-5-carboxylic acid

Systemtic Name: 2-cyclopropyl-4-methyl-6-[(5-methylfuran-2-yl)methylsulfanyl]pyrimidine-5-carboxylic acid Openeye Name: 2-cyclopropyl-4-methyl-6-[(5-methyl-2-furyl)methylsulfanyl]pyrimidine-5-carboxylic acid CAS Name: 2-cyclopropyl-4-methyl-6-[(5-methyl-2-furanyl)methylthio]-5-pyrimidinecarboxylic acid IUPAC Name: 2-cyclopropyl-4-methyl-6-[(5-methylfuran-2-yl)methylsulfanyl]pyrimidine-5-carboxylic acid Traditional Name: 2-cyclopropyl-4-methyl-6-[(5-methyl-2-furyl)methylthio]pyrimidine-5-carboxylic acid Formula: C15H16N2O3S MolecularWeight: 304.36414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CSC2=NC(=NC(=C2C(=O)O)C)C3CC3

Isomeric SMILES

CC1=CC=C(O1)CSC2=NC(=NC(=C2C(=O)O)C)C3CC3

InChI

InChI=1S/C15H16N2O3S/c1-8-3-6-11(20-8)7-21-14-12(15(18)19)9(2)16-13(17-14)10-4-5-10/h3,6,10H,4-5,7H2,1-2H3,(H,18,19)