methyl 3-[[1-(2-methoxy-5-methyl-phenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]propanoate

Systemtic Name: methyl 3-[[1-(2-methoxy-5-methyl-phenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]propanoate Openeye Name: methyl 3-[1-(2-methoxy-5-methyl-phenyl)tetrazol-5-yl]sulfanylpropanoate CAS Name: 3-[[1-(2-methoxy-5-methylphenyl)-5-tetrazolyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[1-(2-methoxy-5-methylphenyl)tetrazol-5-yl]sulfanylpropanoate Traditional Name: 3-[[1-(2-methoxy-5-methyl-phenyl)tetrazol-5-yl]thio]propionic acid methyl ester Formula: C13H16N4O3S MolecularWeight: 308.35614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)N2C(=NN=N2)SCCC(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)OC)N2C(=NN=N2)SCCC(=O)OC

InChI

InChI=1S/C13H16N4O3S/c1-9-4-5-11(19-2)10(8-9)17-13(14-15-16-17)21-7-6-12(18)20-3/h4-5,8H,6-7H2,1-3H3