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

Systemtic Name: 4-[(E)-3-imidazol-1-yl-2-(1,3-thiazol-2-yl)prop-1-enyl]-2-pyridin-3-yl-benzoic acid Openeye Name: 4-[(E)-3-imidazol-1-yl-2-thiazol-2-yl-prop-1-enyl]-2-(3-pyridyl)benzoic acid CAS Name: 4-[(E)-3-(1-imidazolyl)-2-(2-thiazolyl)prop-1-enyl]-2-(3-pyridinyl)benzoic acid IUPAC Name: 4-[(E)-3-imidazol-1-yl-2-(1,3-thiazol-2-yl)prop-1-enyl]-2-pyridin-3-ylbenzoic acid Traditional Name: 4-[(E)-3-imidazol-1-yl-2-thiazol-2-yl-prop-1-enyl]-2-(3-pyridyl)benzoic acid Formula: C21H16N4O2S MolecularWeight: 388.44234

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H16N4O2S/c26-21(27)18-4-3-15(11-19(18)16-2-1-5-22-12-16)10-17(20-24-7-9-28-20)13-25-8-6-23-14-25/h1-12,14H,13H2,(H,26,27)/b17-10+