methyl 7-oxidanylidene-2-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxylate

Systemtic Name: methyl 7-oxidanylidene-2-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxylate Openeye Name: methyl 7-oxo-2-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxylate CAS Name: 7-oxo-2-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 7-oxo-2-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxylate Traditional Name: 7-keto-2-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxylic acid methyl ester Formula: C13H9N3O3S MolecularWeight: 287.29386

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=O)N=C2N1N=C(S2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=O)N=C2N1N=C(S2)C3=CC=CC=C3

InChI

InChI=1S/C13H9N3O3S/c1-19-12(18)9-7-10(17)14-13-16(9)15-11(20-13)8-5-3-2-4-6-8/h2-7H,1H3