2-[4-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyano-ethenyl]phenoxy]-N-phenyl-ethanamide

Systemtic Name: 2-[4-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyano-ethenyl]phenoxy]-N-phenyl-ethanamide Openeye Name: 2-[4-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyano-vinyl]phenoxy]-N-phenyl-acetamide CAS Name: 2-[4-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]phenoxy]-N-phenylacetamide IUPAC Name: 2-[4-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]phenoxy]-N-phenylacetamide Traditional Name: 2-[4-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyano-vinyl]phenoxy]-N-phenyl-acetamide Formula: C24H17N3O2S MolecularWeight: 411.47568

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)COC2=CC=C(C=C2)C=C(C#N)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)COC2=CC=C(C=C2)/C=C(\C#N)/C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C24H17N3O2S/c25-15-18(24-27-21-8-4-5-9-22(21)30-24)14-17-10-12-20(13-11-17)29-16-23(28)26-19-6-2-1-3-7-19/h1-14H,16H2,(H,26,28)/b18-14+