N-(4-nitrophenyl)-5-oxidanylidene-1-sulfanylidene-4H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide

Systemtic Name: N-(4-nitrophenyl)-5-oxidanylidene-1-sulfanylidene-4H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide Openeye Name: N-(4-nitrophenyl)-5-oxo-1-thioxo-4H-thiazolo[3,4-a]quinazoline-3-carboxamide CAS Name: N-(4-nitrophenyl)-5-oxo-1-sulfanylidene-4H-thiazolo[3,4-a]quinazoline-3-carboxamide IUPAC Name: N-(4-nitrophenyl)-5-oxo-1-sulfanylidene-4H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide Traditional Name: 5-keto-N-(4-nitrophenyl)-1-thioxo-4H-thiazolo[3,4-a]quinazoline-3-carboxamide Formula: C17H10N4O4S2 MolecularWeight: 398.4157

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NC3=C(SC(=S)N23)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NC3=C(SC(=S)N23)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H10N4O4S2/c22-15-11-3-1-2-4-12(11)20-14(19-15)13(27-17(20)26)16(23)18-9-5-7-10(8-6-9)21(24)25/h1-8H,(H,18,23)(H,19,22)