(E)-2-(1,3-benzothiazol-2-yl)-3-(4-phenylazanylphenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(4-phenylazanylphenyl)prop-2-enenitrile Openeye Name: (E)-3-(4-anilinophenyl)-2-(1,3-benzothiazol-2-yl)prop-2-enenitrile CAS Name: (E)-3-(4-anilinophenyl)-2-(1,3-benzothiazol-2-yl)-2-propenenitrile IUPAC Name: (E)-3-(4-anilinophenyl)-2-(1,3-benzothiazol-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(4-anilinophenyl)-2-(1,3-benzothiazol-2-yl)acrylonitrile Formula: C22H15N3S MolecularWeight: 353.4396

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=CC=C(C=C2)C=C(C#N)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)NC2=CC=C(C=C2)/C=C(\C#N)/C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H15N3S/c23-15-17(22-25-20-8-4-5-9-21(20)26-22)14-16-10-12-19(13-11-16)24-18-6-2-1-3-7-18/h1-14,24H/b17-14+