(E,4E)-4-(3-ethyl-1,3-benzothiazol-2-ylidene)but-2-enoate

Systemtic Name: (E,4E)-4-(3-ethyl-1,3-benzothiazol-2-ylidene)but-2-enoate Openeye Name: (E,4E)-4-(3-ethyl-1,3-benzothiazol-2-ylidene)but-2-enoate CAS Name: (E,4E)-4-(3-ethyl-1,3-benzothiazol-2-ylidene)-2-butenoate IUPAC Name: (E,4E)-4-(3-ethyl-1,3-benzothiazol-2-ylidene)but-2-enoate Traditional Name: (E,4E)-4-(3-ethyl-1,3-benzothiazol-2-ylidene)but-2-enoate Formula: C13H12NO2S- MolecularWeight: 246.30488

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2SC1=CC=CC(=O)[O-]

Isomeric SMILES

CCN\1C2=CC=CC=C2S/C1=C/C=C/C(=O)[O-]

InChI

InChI=1S/C13H13NO2S/c1-2-14-10-6-3-4-7-11(10)17-12(14)8-5-9-13(15)16/h3-9H,2H2,1H3,(H,15,16)/p-1/b9-5+,12-8+