(3-fluoranyl-4-methoxy-phenyl)methyl 3-(1,3-benzothiazol-2-yl)pyrazine-2-carboxylate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl 3-(1,3-benzothiazol-2-yl)pyrazine-2-carboxylate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl 3-(1,3-benzothiazol-2-yl)pyrazine-2-carboxylate CAS Name: 3-(1,3-benzothiazol-2-yl)-2-pyrazinecarboxylic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl 3-(1,3-benzothiazol-2-yl)pyrazine-2-carboxylate Traditional Name: 3-(1,3-benzothiazol-2-yl)pyrazinic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C20H14FN3O3S MolecularWeight: 395.406863

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)COC(=O)C2=NC=CN=C2C3=NC4=CC=CC=C4S3)F

Isomeric SMILES

COC1=C(C=C(C=C1)COC(=O)C2=NC=CN=C2C3=NC4=CC=CC=C4S3)F

InChI

InChI=1S/C20H14FN3O3S/c1-26-15-7-6-12(10-13(15)21)11-27-20(25)18-17(22-8-9-23-18)19-24-14-4-2-3-5-16(14)28-19/h2-10H,11H2,1H3