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

Systemtic Name: N-(4-butoxyphenyl)-7-oxidanylidene-4H-[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide Openeye Name: N-(4-butoxyphenyl)-7-oxo-4H-isothiazolo[4,3-d]pyrimidine-3-carboxamide CAS Name: N-(4-butoxyphenyl)-7-oxo-4H-isothiazolo[4,3-d]pyrimidine-3-carboxamide IUPAC Name: N-(4-butoxyphenyl)-7-oxo-4H-[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide Traditional Name: N-(4-butoxyphenyl)-7-keto-4H-isothiazolo[4,3-d]pyrimidine-3-carboxamide Formula: C16H16N4O3S MolecularWeight: 344.38824

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=O)C2=C3C(=NS2)C(=O)N=CN3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=O)C2=C3C(=NS2)C(=O)N=CN3

InChI

InChI=1S/C16H16N4O3S/c1-2-3-8-23-11-6-4-10(5-7-11)19-16(22)14-12-13(20-24-14)15(21)18-9-17-12/h4-7,9H,2-3,8H2,1H3,(H,19,22)(H,17,18,21)