4-[(2-methyl-1,3-benzothiazol-5-yl)amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: 4-[(2-methyl-1,3-benzothiazol-5-yl)amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: 4-[(2-methyl-1,3-benzothiazol-5-yl)amino]-4-oxo-but-2-enoic acid CAS Name: 4-[(2-methyl-1,3-benzothiazol-5-yl)amino]-4-oxo-2-butenoic acid IUPAC Name: 4-[(2-methyl-1,3-benzothiazol-5-yl)amino]-4-oxobut-2-enoic acid Traditional Name: 4-keto-4-[(2-methyl-1,3-benzothiazol-5-yl)amino]but-2-enoic acid Formula: C12H10N2O3S MolecularWeight: 262.2844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=CC(=C2)NC(=O)C=CC(=O)O

Isomeric SMILES

CC1=NC2=C(S1)C=CC(=C2)NC(=O)C=CC(=O)O

InChI

InChI=1S/C12H10N2O3S/c1-7-13-9-6-8(2-3-10(9)18-7)14-11(15)4-5-12(16)17/h2-6H,1H3,(H,14,15)(H,16,17)