7-oxidanylidene-2-phenethyl-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxylic acid

Systemtic Name: 7-oxidanylidene-2-phenethyl-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxylic acid Openeye Name: 7-oxo-2-phenethyl-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxylic acid CAS Name: 7-oxo-2-phenethyl-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxylic acid IUPAC Name: 7-oxo-2-phenethyl-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxylic acid Traditional Name: 7-keto-2-phenethyl-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxylic acid Formula: C14H11N3O3S MolecularWeight: 301.32044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=NN3C(=CC(=O)N=C3S2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCC2=NN3C(=CC(=O)N=C3S2)C(=O)O

InChI

InChI=1S/C14H11N3O3S/c18-11-8-10(13(19)20)17-14(15-11)21-12(16-17)7-6-9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H,19,20)