2-[(5,5-dimethyl-7-oxidanylidene-4,6-dihydro-1,3-benzothiazol-2-yl)carbamoyl-methyl-amino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[(5,5-dimethyl-7-oxidanylidene-4,6-dihydro-1,3-benzothiazol-2-yl)carbamoyl-methyl-amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)carbamoyl-methyl-amino]-2-oxo-acetic acid CAS Name: 2-[[[(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)amino]-oxomethyl]-methylamino]-2-oxoacetic acid IUPAC Name: 2-[(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)carbamoyl-methylamino]-2-oxoacetic acid Traditional Name: 2-keto-2-[(7-keto-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-2-yl)carbamoyl-methyl-amino]acetic acid Formula: C13H15N3O5S MolecularWeight: 325.3403

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1)SC(=N2)NC(=O)N(C)C(=O)C(=O)O)C

Isomeric SMILES

CC1(CC2=C(C(=O)C1)SC(=N2)NC(=O)N(C)C(=O)C(=O)O)C

InChI

InChI=1S/C13H15N3O5S/c1-13(2)4-6-8(7(17)5-13)22-11(14-6)15-12(21)16(3)9(18)10(19)20/h4-5H2,1-3H3,(H,19,20)(H,14,15,21)