4-(2-diethylaminoethylsulfanyl)-6-methyl-2-propan-2-yl-pyrimidine-5-carboxylic acid

Systemtic Name: 4-(2-diethylaminoethylsulfanyl)-6-methyl-2-propan-2-yl-pyrimidine-5-carboxylic acid Openeye Name: 4-(2-diethylaminoethylsulfanyl)-2-isopropyl-6-methyl-pyrimidine-5-carboxylic acid CAS Name: 4-(2-diethylaminoethylthio)-6-methyl-2-propan-2-yl-5-pyrimidinecarboxylic acid IUPAC Name: 4-(2-diethylaminoethylsulfanyl)-6-methyl-2-propan-2-ylpyrimidine-5-carboxylic acid Traditional Name: 4-(2-diethylaminoethylthio)-2-isopropyl-6-methyl-pyrimidine-5-carboxylic acid Formula: C15H25N3O2S MolecularWeight: 311.4429

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCSC1=NC(=NC(=C1C(=O)O)C)C(C)C

Isomeric SMILES

CCN(CC)CCSC1=NC(=NC(=C1C(=O)O)C)C(C)C

InChI

InChI=1S/C15H25N3O2S/c1-6-18(7-2)8-9-21-14-12(15(19)20)11(5)16-13(17-14)10(3)4/h10H,6-9H2,1-5H3,(H,19,20)