diethyl (E)-2-[(2-oxidanylidene-3H-1,3-benzothiazol-6-yl)amino]but-2-enedioate

Systemtic Name: diethyl (E)-2-[(2-oxidanylidene-3H-1,3-benzothiazol-6-yl)amino]but-2-enedioate Openeye Name: diethyl (E)-2-[(2-oxo-3H-1,3-benzothiazol-6-yl)amino]but-2-enedioate CAS Name: (E)-2-[(2-oxo-3H-1,3-benzothiazol-6-yl)amino]-2-butenedioic acid diethyl ester IUPAC Name: diethyl (E)-2-[(2-oxo-3H-1,3-benzothiazol-6-yl)amino]but-2-enedioate Traditional Name: (E)-2-[(2-keto-3H-1,3-benzothiazol-6-yl)amino]but-2-enedioic acid diethyl ester Formula: C15H16N2O5S MolecularWeight: 336.36294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C(=O)OCC)NC1=CC2=C(C=C1)NC(=O)S2

Isomeric SMILES

CCOC(=O)/C=C(\C(=O)OCC)/NC1=CC2=C(C=C1)NC(=O)S2

InChI

InChI=1S/C15H16N2O5S/c1-3-21-13(18)8-11(14(19)22-4-2)16-9-5-6-10-12(7-9)23-15(20)17-10/h5-8,16H,3-4H2,1-2H3,(H,17,20)/b11-8+