2-[(E)-2-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]ethenyl]-1,3-benzothiazole

Systemtic Name: 2-[(E)-2-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]ethenyl]-1,3-benzothiazole Openeye Name: 2-[(E)-2-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]vinyl]-1,3-benzothiazole CAS Name: 2-[(E)-2-[3-(2-benzofuranyl)-1-phenyl-4-pyrazolyl]ethenyl]-1,3-benzothiazole IUPAC Name: 2-[(E)-2-[3-(1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]ethenyl]-1,3-benzothiazole Traditional Name: 2-[(E)-2-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]vinyl]-1,3-benzothiazole Formula: C26H17N3OS MolecularWeight: 419.49768

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC4=CC=CC=C4O3)C=CC5=NC6=CC=CC=C6S5

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC4=CC=CC=C4O3)/C=C/C5=NC6=CC=CC=C6S5

InChI

InChI=1S/C26H17N3OS/c1-2-9-20(10-3-1)29-17-19(14-15-25-27-21-11-5-7-13-24(21)31-25)26(28-29)23-16-18-8-4-6-12-22(18)30-23/h1-17H/b15-14+