(E)-4-(1,3-benzothiazol-2-yl)-5-(4-cyanophenyl)pent-4-enoate

Systemtic Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(4-cyanophenyl)pent-4-enoate Openeye Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(4-cyanophenyl)pent-4-enoate CAS Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(4-cyanophenyl)-4-pentenoate IUPAC Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(4-cyanophenyl)pent-4-enoate Traditional Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(4-cyanophenyl)pent-4-enoate Formula: C19H13N2O2S- MolecularWeight: 333.38372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H14N2O2S/c20-12-14-7-5-13(6-8-14)11-15(9-10-18(22)23)19-21-16-3-1-2-4-17(16)24-19/h1-8,11H,9-10H2,(H,22,23)/p-1/b15-11+