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

Systemtic Name: ethyl (E,4Z)-4-(3-ethyl-1,3-benzothiazol-2-ylidene)-2-(phenylcarbonyl)but-2-enoate Openeye Name: ethyl (E,4Z)-2-benzoyl-4-(3-ethyl-1,3-benzothiazol-2-ylidene)but-2-enoate CAS Name: (E,4Z)-2-benzoyl-4-(3-ethyl-1,3-benzothiazol-2-ylidene)-2-butenoic acid ethyl ester IUPAC Name: ethyl (E,4Z)-2-benzoyl-4-(3-ethyl-1,3-benzothiazol-2-ylidene)but-2-enoate Traditional Name: (E,4Z)-2-benzoyl-4-(3-ethyl-1,3-benzothiazol-2-ylidene)but-2-enoic acid ethyl ester Formula: C22H21NO3S MolecularWeight: 379.47204

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2SC1=CC=C(C(=O)C3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCN\1C2=CC=CC=C2S/C1=C\C=C(/C(=O)C3=CC=CC=C3)\C(=O)OCC

InChI

InChI=1S/C22H21NO3S/c1-3-23-18-12-8-9-13-19(18)27-20(23)15-14-17(22(25)26-4-2)21(24)16-10-6-5-7-11-16/h5-15H,3-4H2,1-2H3/b17-14+,20-15-