(E)-2-(1,3-benzothiazol-2-yl)-3-(3-phenyl-2,1-benzoxazol-5-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(3-phenyl-2,1-benzoxazol-5-yl)prop-2-enenitrile Openeye Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(3-phenyl-2,1-benzoxazol-5-yl)prop-2-enenitrile CAS Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(3-phenyl-2,1-benzoxazol-5-yl)-2-propenenitrile IUPAC Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(3-phenyl-2,1-benzoxazol-5-yl)prop-2-enenitrile Traditional Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(3-phenylanthranil-5-yl)acrylonitrile Formula: C23H13N3OS MolecularWeight: 379.43382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=C(C=CC3=NO2)C=C(C#N)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=C(C=CC3=NO2)/C=C(\C#N)/C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H13N3OS/c24-14-17(23-25-20-8-4-5-9-21(20)28-23)12-15-10-11-19-18(13-15)22(27-26-19)16-6-2-1-3-7-16/h1-13H/b17-12+