diethyl 2-[[[(Z)-1-(1,3-benzothiazol-2-ylamino)-3-ethoxy-3-oxidanylidene-prop-1-en-2-yl]amino]methylidene]propanedioate

Systemtic Name: diethyl 2-[[[(Z)-1-(1,3-benzothiazol-2-ylamino)-3-ethoxy-3-oxidanylidene-prop-1-en-2-yl]amino]methylidene]propanedioate Openeye Name: diethyl 2-[[[(Z)-2-(1,3-benzothiazol-2-ylamino)-1-ethoxycarbonyl-vinyl]amino]methylene]propanedioate CAS Name: 2-[[[(Z)-1-(1,3-benzothiazol-2-ylamino)-3-ethoxy-3-oxoprop-1-en-2-yl]amino]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[[(Z)-1-(1,3-benzothiazol-2-ylamino)-3-ethoxy-3-oxoprop-1-en-2-yl]amino]methylidene]propanedioate Traditional Name: 2-[[[(Z)-2-(1,3-benzothiazol-2-ylamino)-1-carbethoxy-vinyl]amino]methylene]malonic acid diethyl ester Formula: C20H23N3O6S MolecularWeight: 433.47812

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC(=CNC1=NC2=CC=CC=C2S1)C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CN/C(=C\NC1=NC2=CC=CC=C2S1)/C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C20H23N3O6S/c1-4-27-17(24)13(18(25)28-5-2)11-21-15(19(26)29-6-3)12-22-20-23-14-9-7-8-10-16(14)30-20/h7-12,21H,4-6H2,1-3H3,(H,22,23)/b15-12-