[(3Z)-3-cyano-3-(3-methyl-1,3-benzothiazol-2-ylidene)-2-oxidanylidene-propyl] 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate

Systemtic Name: [(3Z)-3-cyano-3-(3-methyl-1,3-benzothiazol-2-ylidene)-2-oxidanylidene-propyl] 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate Openeye Name: [(3Z)-3-cyano-3-(3-methyl-1,3-benzothiazol-2-ylidene)-2-oxo-propyl] 3-ethyl-5-methyl-isoxazole-4-carboxylate CAS Name: 3-ethyl-5-methyl-4-isoxazolecarboxylic acid [(3Z)-3-cyano-3-(3-methyl-1,3-benzothiazol-2-ylidene)-2-oxopropyl] ester IUPAC Name: [(3Z)-3-cyano-3-(3-methyl-1,3-benzothiazol-2-ylidene)-2-oxopropyl] 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate Traditional Name: 3-ethyl-5-methyl-isoxazole-4-carboxylic acid [(3Z)-3-cyano-2-keto-3-(3-methyl-1,3-benzothiazol-2-ylidene)propyl] ester Formula: C19H17N3O4S MolecularWeight: 383.42098

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=C1C(=O)OCC(=O)C(=C2N(C3=CC=CC=C3S2)C)C#N)C

Isomeric SMILES

CCC1=NOC(=C1C(=O)OCC(=O)/C(=C\2/N(C3=CC=CC=C3S2)C)/C#N)C

InChI

InChI=1S/C19H17N3O4S/c1-4-13-17(11(2)26-21-13)19(24)25-10-15(23)12(9-20)18-22(3)14-7-5-6-8-16(14)27-18/h5-8H,4,10H2,1-3H3/b18-12-