4-[(6-methyl-1,3-benzothiazol-2-yl)amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: 4-[(6-methyl-1,3-benzothiazol-2-yl)amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: 4-[(6-methyl-1,3-benzothiazol-2-yl)amino]-4-oxo-but-2-enoic acid CAS Name: 4-[(6-methyl-1,3-benzothiazol-2-yl)amino]-4-oxo-2-butenoic acid IUPAC Name: 4-[(6-methyl-1,3-benzothiazol-2-yl)amino]-4-oxobut-2-enoic acid Traditional Name: 4-keto-4-[(6-methyl-1,3-benzothiazol-2-yl)amino]but-2-enoic acid Formula: C12H10N2O3S MolecularWeight: 262.2844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C=CC(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C=CC(=O)O

InChI

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