4-[[1,1-bis(oxidanylidene)thiolan-3-yl]amino]quinazoline-7-carboxylic acid hydrochloride

Systemtic Name: 4-[[1,1-bis(oxidanylidene)thiolan-3-yl]amino]quinazoline-7-carboxylic acid hydrochloride Openeye Name: 4-[(1,1-dioxothiolan-3-yl)amino]quinazoline-7-carboxylic acid hydrochloride CAS Name: 4-[(1,1-dioxo-3-thiolanyl)amino]-7-quinazolinecarboxylic acid hydrochloride IUPAC Name: 4-[(1,1-dioxothiolan-3-yl)amino]quinazoline-7-carboxylic acid hydrochloride Traditional Name: 4-[(1,1-diketothiolan-3-yl)amino]quinazoline-7-carboxylic acid hydrochloride Formula: C13H14ClN3O4S MolecularWeight: 343.78596

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1NC2=NC=NC3=C2C=CC(=C3)C(=O)O.Cl

Isomeric SMILES

C1CS(=O)(=O)CC1NC2=NC=NC3=C2C=CC(=C3)C(=O)O.Cl

InChI

InChI=1S/C13H13N3O4S.ClH/c17-13(18)8-1-2-10-11(5-8)14-7-15-12(10)16-9-3-4-21(19,20)6-9;/h1-2,5,7,9H,3-4,6H2,(H,17,18)(H,14,15,16);1H