5-oxidanylidene-3-pyrrolidin-1-ylcarbonyl-1-sulfanylidene-4H-[1,3]thiazolo[3,4-a]quinazoline-8-carboxylic acid

Systemtic Name: 5-oxidanylidene-3-pyrrolidin-1-ylcarbonyl-1-sulfanylidene-4H-[1,3]thiazolo[3,4-a]quinazoline-8-carboxylic acid Openeye Name: 5-oxo-3-(pyrrolidine-1-carbonyl)-1-thioxo-4H-thiazolo[3,4-a]quinazoline-8-carboxylic acid CAS Name: 5-oxo-3-[oxo(1-pyrrolidinyl)methyl]-1-sulfanylidene-4H-thiazolo[3,4-a]quinazoline-8-carboxylic acid IUPAC Name: 5-oxo-3-(pyrrolidine-1-carbonyl)-1-sulfanylidene-4H-[1,3]thiazolo[3,4-a]quinazoline-8-carboxylic acid Traditional Name: 5-keto-3-(pyrrolidine-1-carbonyl)-1-thioxo-4H-thiazolo[3,4-a]quinazoline-8-carboxylic acid Formula: C16H13N3O4S2 MolecularWeight: 375.42212

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=C3NC(=O)C4=C(N3C(=S)S2)C=C(C=C4)C(=O)O

Isomeric SMILES

C1CCN(C1)C(=O)C2=C3NC(=O)C4=C(N3C(=S)S2)C=C(C=C4)C(=O)O

InChI

InChI=1S/C16H13N3O4S2/c20-13-9-4-3-8(15(22)23)7-10(9)19-12(17-13)11(25-16(19)24)14(21)18-5-1-2-6-18/h3-4,7H,1-2,5-6H2,(H,17,20)(H,22,23)