1-(4-methoxyphenyl)-2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propan-1-one

Systemtic Name: 1-(4-methoxyphenyl)-2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propan-1-one Openeye Name: 1-(4-methoxyphenyl)-2-(1-methyltetrazol-5-yl)sulfanyl-propan-1-one CAS Name: 1-(4-methoxyphenyl)-2-[(1-methyl-5-tetrazolyl)thio]-1-propanone IUPAC Name: 1-(4-methoxyphenyl)-2-(1-methyltetrazol-5-yl)sulfanylpropan-1-one Traditional Name: 1-(4-methoxyphenyl)-2-[(1-methyltetrazol-5-yl)thio]propan-1-one Formula: C12H14N4O2S MolecularWeight: 278.33016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)OC)SC2=NN=NN2C

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)OC)SC2=NN=NN2C

InChI

InChI=1S/C12H14N4O2S/c1-8(19-12-13-14-15-16(12)2)11(17)9-4-6-10(18-3)7-5-9/h4-8H,1-3H3