3-[(E)-3-imidazol-1-yl-2-(1,3-thiazol-2-yl)prop-1-enyl]-5-phenyl-benzoic acid

Systemtic Name: 3-[(E)-3-imidazol-1-yl-2-(1,3-thiazol-2-yl)prop-1-enyl]-5-phenyl-benzoic acid Openeye Name: 3-[(E)-3-imidazol-1-yl-2-thiazol-2-yl-prop-1-enyl]-5-phenyl-benzoic acid CAS Name: 3-[(E)-3-(1-imidazolyl)-2-(2-thiazolyl)prop-1-enyl]-5-phenylbenzoic acid IUPAC Name: 3-[(E)-3-imidazol-1-yl-2-(1,3-thiazol-2-yl)prop-1-enyl]-5-phenylbenzoic acid Traditional Name: 3-[(E)-3-imidazol-1-yl-2-thiazol-2-yl-prop-1-enyl]-5-phenyl-benzoic acid Formula: C22H17N3O2S MolecularWeight: 387.45428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=CC(=C2)C(=O)O)C=C(CN3C=CN=C3)C4=NC=CS4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=CC(=C2)C(=O)O)/C=C(\CN3C=CN=C3)/C4=NC=CS4

InChI

InChI=1S/C22H17N3O2S/c26-22(27)19-11-16(10-18(13-19)17-4-2-1-3-5-17)12-20(21-24-7-9-28-21)14-25-8-6-23-15-25/h1-13,15H,14H2,(H,26,27)/b20-12+