N-(3-ethylphenyl)-7-oxidanylidene-4H-[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide

Systemtic Name: N-(3-ethylphenyl)-7-oxidanylidene-4H-[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide Openeye Name: N-(3-ethylphenyl)-7-oxo-4H-isothiazolo[4,3-d]pyrimidine-3-carboxamide CAS Name: N-(3-ethylphenyl)-7-oxo-4H-isothiazolo[4,3-d]pyrimidine-3-carboxamide IUPAC Name: N-(3-ethylphenyl)-7-oxo-4H-[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide Traditional Name: N-(3-ethylphenyl)-7-keto-4H-isothiazolo[4,3-d]pyrimidine-3-carboxamide Formula: C14H12N4O2S MolecularWeight: 300.33568

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)C2=C3C(=NS2)C(=O)N=CN3

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)C2=C3C(=NS2)C(=O)N=CN3

InChI

InChI=1S/C14H12N4O2S/c1-2-8-4-3-5-9(6-8)17-14(20)12-10-11(18-21-12)13(19)16-7-15-10/h3-7H,2H2,1H3,(H,17,20)(H,15,16,19)