(4-cyanophenyl)methyl 2-(5-thiophen-3-yl-1,2,3,4-tetrazol-2-yl)ethanoate

Systemtic Name: (4-cyanophenyl)methyl 2-(5-thiophen-3-yl-1,2,3,4-tetrazol-2-yl)ethanoate Openeye Name: (4-cyanophenyl)methyl 2-[5-(3-thienyl)tetrazol-2-yl]acetate CAS Name: 2-[5-(3-thiophenyl)-2-tetrazolyl]acetic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 2-(5-thiophen-3-yltetrazol-2-yl)acetate Traditional Name: 2-[5-(3-thienyl)tetrazol-2-yl]acetic acid (4-cyanobenzyl) ester Formula: C15H11N5O2S MolecularWeight: 325.34514

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC(=O)CN2N=C(N=N2)C3=CSC=C3)C#N

Isomeric SMILES

C1=CC(=CC=C1COC(=O)CN2N=C(N=N2)C3=CSC=C3)C#N

InChI

InChI=1S/C15H11N5O2S/c16-7-11-1-3-12(4-2-11)9-22-14(21)8-20-18-15(17-19-20)13-5-6-23-10-13/h1-6,10H,8-9H2