(2-ethoxycarbonyl-4-fluoranyl-1-benzothiophen-3-yl)methyl 3-azanylpyrazine-2-carboxylate

Systemtic Name: (2-ethoxycarbonyl-4-fluoranyl-1-benzothiophen-3-yl)methyl 3-azanylpyrazine-2-carboxylate Openeye Name: (2-ethoxycarbonyl-4-fluoro-benzothiophen-3-yl)methyl 3-aminopyrazine-2-carboxylate CAS Name: 3-amino-2-pyrazinecarboxylic acid (2-ethoxycarbonyl-4-fluoro-1-benzothiophen-3-yl)methyl ester IUPAC Name: (2-ethoxycarbonyl-4-fluoro-1-benzothiophen-3-yl)methyl 3-aminopyrazine-2-carboxylate Traditional Name: 3-aminopyrazinic acid (2-carbethoxy-4-fluoro-benzothiophen-3-yl)methyl ester Formula: C17H14FN3O4S MolecularWeight: 375.374163

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)COC(=O)C3=NC=CN=C3N

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)COC(=O)C3=NC=CN=C3N

InChI

InChI=1S/C17H14FN3O4S/c1-2-24-17(23)14-9(12-10(18)4-3-5-11(12)26-14)8-25-16(22)13-15(19)21-7-6-20-13/h3-7H,2,8H2,1H3,(H2,19,21)