5-chloranyl-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylsulfanyl]pyrimidine-4-carboxylate

Systemtic Name: 5-chloranyl-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylsulfanyl]pyrimidine-4-carboxylate Openeye Name: 5-chloro-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylsulfanyl]pyrimidine-4-carboxylate CAS Name: 5-chloro-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylthio]-4-pyrimidinecarboxylate IUPAC Name: 5-chloro-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylsulfanyl]pyrimidine-4-carboxylate Traditional Name: 5-chloro-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylthio]pyrimidine-4-carboxylate Formula: C9H6ClN4O3S- MolecularWeight: 285.68694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NO1)CSC2=NC=C(C(=N2)C(=O)[O-])Cl

Isomeric SMILES

CC1=NC(=NO1)CSC2=NC=C(C(=N2)C(=O)[O-])Cl

InChI

InChI=1S/C9H7ClN4O3S/c1-4-12-6(14-17-4)3-18-9-11-2-5(10)7(13-9)8(15)16/h2H,3H2,1H3,(H,15,16)/p-1