O1-ethyl O3-methyl (2E)-2-[[(2-methyl-1,3-benzothiazol-6-yl)amino]methylidene]propanedioate

Systemtic Name: O1-ethyl O3-methyl (2E)-2-[[(2-methyl-1,3-benzothiazol-6-yl)amino]methylidene]propanedioate Openeye Name: O1-ethyl O3-methyl (2E)-2-[[(2-methyl-1,3-benzothiazol-6-yl)amino]methylene]propanedioate CAS Name: (2E)-2-[[(2-methyl-1,3-benzothiazol-6-yl)amino]methylidene]propanedioic acid O1-ethyl ester O3-methyl ester IUPAC Name: 1-O-ethyl 3-O-methyl (2E)-2-[[(2-methyl-1,3-benzothiazol-6-yl)amino]methylidene]propanedioate Traditional Name: (2E)-2-[[(2-methyl-1,3-benzothiazol-6-yl)amino]methylene]malonic acid O1-ethyl ester O3-methyl ester Formula: C15H16N2O4S MolecularWeight: 320.36354

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CC2=C(C=C1)N=C(S2)C)C(=O)OC

Isomeric SMILES

CCOC(=O)/C(=C/NC1=CC2=C(C=C1)N=C(S2)C)/C(=O)OC

InChI

InChI=1S/C15H16N2O4S/c1-4-21-15(19)11(14(18)20-3)8-16-10-5-6-12-13(7-10)22-9(2)17-12/h5-8,16H,4H2,1-3H3/b11-8+