(E)-2-(1,3-benzothiazol-2-ylsulfanyl)-3-(4-cyanophenyl)prop-2-enoate

Systemtic Name: (E)-2-(1,3-benzothiazol-2-ylsulfanyl)-3-(4-cyanophenyl)prop-2-enoate Openeye Name: (E)-2-(1,3-benzothiazol-2-ylsulfanyl)-3-(4-cyanophenyl)prop-2-enoate CAS Name: (E)-2-(1,3-benzothiazol-2-ylthio)-3-(4-cyanophenyl)-2-propenoate IUPAC Name: (E)-2-(1,3-benzothiazol-2-ylsulfanyl)-3-(4-cyanophenyl)prop-2-enoate Traditional Name: (E)-2-(1,3-benzothiazol-2-ylthio)-3-(4-cyanophenyl)acrylate Formula: C17H9N2O2S2- MolecularWeight: 337.39556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SC(=CC3=CC=C(C=C3)C#N)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)S/C(=C/C3=CC=C(C=C3)C#N)/C(=O)[O-]

InChI

InChI=1S/C17H10N2O2S2/c18-10-12-7-5-11(6-8-12)9-15(16(20)21)23-17-19-13-3-1-2-4-14(13)22-17/h1-9H,(H,20,21)/p-1/b15-9+