4-methoxy-3-[[1-(phenylmethyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]benzaldehyde

Systemtic Name: 4-methoxy-3-[[1-(phenylmethyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]benzaldehyde Openeye Name: 3-[(1-benzyltetrazol-5-yl)sulfanylmethyl]-4-methoxy-benzaldehyde CAS Name: 4-methoxy-3-[[[1-(phenylmethyl)-5-tetrazolyl]thio]methyl]benzaldehyde IUPAC Name: 3-[(1-benzyltetrazol-5-yl)sulfanylmethyl]-4-methoxybenzaldehyde Traditional Name: 3-[[(1-benzyltetrazol-5-yl)thio]methyl]-4-methoxy-benzaldehyde Formula: C17H16N4O2S MolecularWeight: 340.39954

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=O)CSC2=NN=NN2CC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)C=O)CSC2=NN=NN2CC3=CC=CC=C3

InChI

InChI=1S/C17H16N4O2S/c1-23-16-8-7-14(11-22)9-15(16)12-24-17-18-19-20-21(17)10-13-5-3-2-4-6-13/h2-9,11H,10,12H2,1H3