(E)-2-(1,3-benzothiazol-2-yl)-3-(4-fluoranyl-3-phenoxy-phenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(4-fluoranyl-3-phenoxy-phenyl)prop-2-enenitrile Openeye Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(4-fluoro-3-phenoxy-phenyl)prop-2-enenitrile CAS Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(4-fluoro-3-phenoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(4-fluoro-3-phenoxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(4-fluoro-3-phenoxy-phenyl)acrylonitrile Formula: C22H13FN2OS MolecularWeight: 372.414823

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(C=CC(=C2)C=C(C#N)C3=NC4=CC=CC=C4S3)F

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(C=CC(=C2)/C=C(\C#N)/C3=NC4=CC=CC=C4S3)F

InChI

InChI=1S/C22H13FN2OS/c23-18-11-10-15(13-20(18)26-17-6-2-1-3-7-17)12-16(14-24)22-25-19-8-4-5-9-21(19)27-22/h1-13H/b16-12+