2-[5-(4-methyl-1-benzothiophen-2-yl)-1,2,3,4-tetrazol-1-yl]ethanoic acid

Systemtic Name: 2-[5-(4-methyl-1-benzothiophen-2-yl)-1,2,3,4-tetrazol-1-yl]ethanoic acid Openeye Name: 2-[5-(4-methylbenzothiophen-2-yl)tetrazol-1-yl]acetic acid CAS Name: 2-[5-(4-methyl-1-benzothiophen-2-yl)-1-tetrazolyl]acetic acid IUPAC Name: 2-[5-(4-methyl-1-benzothiophen-2-yl)tetrazol-1-yl]acetic acid Traditional Name: 2-[5-(4-methylbenzothiophen-2-yl)tetrazol-1-yl]acetic acid Formula: C12H10N4O2S MolecularWeight: 274.2984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(SC2=CC=C1)C3=NN=NN3CC(=O)O

Isomeric SMILES

CC1=C2C=C(SC2=CC=C1)C3=NN=NN3CC(=O)O

InChI

InChI=1S/C12H10N4O2S/c1-7-3-2-4-9-8(7)5-10(19-9)12-13-14-15-16(12)6-11(17)18/h2-5H,6H2,1H3,(H,17,18)