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

Systemtic Name: (1-propyl-1,2,3,4-tetrazol-5-yl)methyl 4-fluoranyl-3-methyl-1-benzothiophene-2-carboxylate Openeye Name: (1-propyltetrazol-5-yl)methyl 4-fluoro-3-methyl-benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-methyl-1-benzothiophene-2-carboxylic acid (1-propyl-5-tetrazolyl)methyl ester IUPAC Name: (1-propyltetrazol-5-yl)methyl 4-fluoro-3-methyl-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-methyl-benzothiophene-2-carboxylic acid (1-propyltetrazol-5-yl)methyl ester Formula: C15H15FN4O2S MolecularWeight: 334.368603

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)COC(=O)C2=C(C3=C(C=CC=C3S2)F)C

Isomeric SMILES

CCCN1C(=NN=N1)COC(=O)C2=C(C3=C(C=CC=C3S2)F)C

InChI

InChI=1S/C15H15FN4O2S/c1-3-7-20-12(17-18-19-20)8-22-15(21)14-9(2)13-10(16)5-4-6-11(13)23-14/h4-6H,3,7-8H2,1-2H3