(1-propyl-1,2,3,4-tetrazol-5-yl)methyl 5-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: (1-propyl-1,2,3,4-tetrazol-5-yl)methyl 5-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: (1-propyltetrazol-5-yl)methyl 5-fluorobenzothiophene-2-carboxylate CAS Name: 5-fluoro-1-benzothiophene-2-carboxylic acid (1-propyl-5-tetrazolyl)methyl ester IUPAC Name: (1-propyltetrazol-5-yl)methyl 5-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 5-fluorobenzothiophene-2-carboxylic acid (1-propyltetrazol-5-yl)methyl ester Formula: C14H13FN4O2S MolecularWeight: 320.342023

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)COC(=O)C2=CC3=C(S2)C=CC(=C3)F

Isomeric SMILES

CCCN1C(=NN=N1)COC(=O)C2=CC3=C(S2)C=CC(=C3)F

InChI

InChI=1S/C14H13FN4O2S/c1-2-5-19-13(16-17-18-19)8-21-14(20)12-7-9-6-10(15)3-4-11(9)22-12/h3-4,6-7H,2,5,8H2,1H3