methyl 3-methyl-5-[[1-(phenylmethyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]furan-2-carboxylate

Systemtic Name: methyl 3-methyl-5-[[1-(phenylmethyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 5-[(1-benzyltetrazol-5-yl)sulfanylmethyl]-3-methyl-furan-2-carboxylate CAS Name: 3-methyl-5-[[[1-(phenylmethyl)-5-tetrazolyl]thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(1-benzyltetrazol-5-yl)sulfanylmethyl]-3-methylfuran-2-carboxylate Traditional Name: 5-[[(1-benzyltetrazol-5-yl)thio]methyl]-3-methyl-furan-2-carboxylic acid methyl ester Formula: C16H16N4O3S MolecularWeight: 344.38824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1)CSC2=NN=NN2CC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C(OC(=C1)CSC2=NN=NN2CC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C16H16N4O3S/c1-11-8-13(23-14(11)15(21)22-2)10-24-16-17-18-19-20(16)9-12-6-4-3-5-7-12/h3-8H,9-10H2,1-2H3