N-[1,1-bis(oxidanylidene)thiolan-3-yl]-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-(1,1-diketothiolan-3-yl)-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C13H13N3O4S2 MolecularWeight: 339.39002

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1NC(=O)C2=CC3=C(C=C2)C(=O)NC(=S)N3

Isomeric SMILES

C1CS(=O)(=O)CC1NC(=O)C2=CC3=C(C=C2)C(=O)NC(=S)N3

InChI

InChI=1S/C13H13N3O4S2/c17-11(14-8-3-4-22(19,20)6-8)7-1-2-9-10(5-7)15-13(21)16-12(9)18/h1-2,5,8H,3-4,6H2,(H,14,17)(H2,15,16,18,21)