5-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]-4-(1,3-benzothiazol-2-yl)pent-4-enoic acid

Systemtic Name: 5-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]-4-(1,3-benzothiazol-2-yl)pent-4-enoic acid Openeye Name: 5-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]-4-(1,3-benzothiazol-2-yl)pent-4-enoic acid CAS Name: 5-[3-(2-benzofuranyl)-1-phenyl-4-pyrazolyl]-4-(1,3-benzothiazol-2-yl)-4-pentenoic acid IUPAC Name: 5-[3-(1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]-4-(1,3-benzothiazol-2-yl)pent-4-enoic acid Traditional Name: 5-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]-4-(1,3-benzothiazol-2-yl)pent-4-enoic acid Formula: C29H21N3O3S MolecularWeight: 491.56034

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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=C(CCC(=O)O)C5=NC6=CC=CC=C6S5

Isomeric SMILES

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

InChI

InChI=1S/C29H21N3O3S/c33-27(34)15-14-20(29-30-23-11-5-7-13-26(23)36-29)16-21-18-32(22-9-2-1-3-10-22)31-28(21)25-17-19-8-4-6-12-24(19)35-25/h1-13,16-18H,14-15H2,(H,33,34)