2-[[3-methyl-2,4-bis(oxidanylidene)-1H-quinazolin-6-yl]sulfonylamino]propanoic acid

Systemtic Name: 2-[[3-methyl-2,4-bis(oxidanylidene)-1H-quinazolin-6-yl]sulfonylamino]propanoic acid Openeye Name: 2-[(3-methyl-2,4-dioxo-1H-quinazolin-6-yl)sulfonylamino]propanoic acid CAS Name: 2-[(3-methyl-2,4-dioxo-1H-quinazolin-6-yl)sulfonylamino]propanoic acid IUPAC Name: 2-[(3-methyl-2,4-dioxo-1H-quinazolin-6-yl)sulfonylamino]propanoic acid Traditional Name: 2-[(2,4-diketo-3-methyl-1H-quinazolin-6-yl)sulfonylamino]propionic acid Formula: C12H13N3O6S MolecularWeight: 327.31312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NS(=O)(=O)C1=CC2=C(C=C1)NC(=O)N(C2=O)C

Isomeric SMILES

CC(C(=O)O)NS(=O)(=O)C1=CC2=C(C=C1)NC(=O)N(C2=O)C

InChI

InChI=1S/C12H13N3O6S/c1-6(11(17)18)14-22(20,21)7-3-4-9-8(5-7)10(16)15(2)12(19)13-9/h3-6,14H,1-2H3,(H,13,19)(H,17,18)