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

Systemtic Name: methyl 4-[(E)-3-imidazol-1-yl-2-(1,3-thiazol-2-yl)prop-1-enyl]-2-pyridin-3-yl-benzoate Openeye Name: methyl 4-[(E)-3-imidazol-1-yl-2-thiazol-2-yl-prop-1-enyl]-2-(3-pyridyl)benzoate CAS Name: 4-[(E)-3-(1-imidazolyl)-2-(2-thiazolyl)prop-1-enyl]-2-(3-pyridinyl)benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-imidazol-1-yl-2-(1,3-thiazol-2-yl)prop-1-enyl]-2-pyridin-3-ylbenzoate Traditional Name: 4-[(E)-3-imidazol-1-yl-2-thiazol-2-yl-prop-1-enyl]-2-(3-pyridyl)benzoic acid methyl ester Formula: C22H18N4O2S MolecularWeight: 402.46892

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)C=C(CN2C=CN=C2)C3=NC=CS3)C4=CN=CC=C4

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)/C=C(\CN2C=CN=C2)/C3=NC=CS3)C4=CN=CC=C4

InChI

InChI=1S/C22H18N4O2S/c1-28-22(27)19-5-4-16(12-20(19)17-3-2-6-23-13-17)11-18(21-25-8-10-29-21)14-26-9-7-24-15-26/h2-13,15H,14H2,1H3/b18-11+