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

Systemtic Name: (E)-4-[(2-methyl-1,3-benzothiazol-5-yl)amino]-4-oxidanylidene-but-2-enoate Openeye Name: (E)-4-[(2-methyl-1,3-benzothiazol-5-yl)amino]-4-oxo-but-2-enoate CAS Name: (E)-4-[(2-methyl-1,3-benzothiazol-5-yl)amino]-4-oxo-2-butenoate IUPAC Name: (E)-4-[(2-methyl-1,3-benzothiazol-5-yl)amino]-4-oxobut-2-enoate Traditional Name: (E)-4-keto-4-[(2-methyl-1,3-benzothiazol-5-yl)amino]but-2-enoate Formula: C12H9N2O3S- MolecularWeight: 261.27646

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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=C/C(=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)/p-1/b5-4+