diethyl 2-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]carbonylamino]propanedioate

Systemtic Name: diethyl 2-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]carbonylamino]propanedioate Openeye Name: diethyl 2-[[5-(1,3-benzothiazol-2-yl)furan-2-carbonyl]amino]propanedioate CAS Name: 2-[[[5-(1,3-benzothiazol-2-yl)-2-furanyl]-oxomethyl]amino]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[5-(1,3-benzothiazol-2-yl)furan-2-carbonyl]amino]propanedioate Traditional Name: 2-[[5-(1,3-benzothiazol-2-yl)-2-furoyl]amino]malonic acid diethyl ester Formula: C19H18N2O6S MolecularWeight: 402.42102

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)OCC)NC(=O)C1=CC=C(O1)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CCOC(=O)C(C(=O)OCC)NC(=O)C1=CC=C(O1)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H18N2O6S/c1-3-25-18(23)15(19(24)26-4-2)21-16(22)12-9-10-13(27-12)17-20-11-7-5-6-8-14(11)28-17/h5-10,15H,3-4H2,1-2H3,(H,21,22)