1-(4-methoxyphenyl)-2-[(1-prop-2-enyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanone

Systemtic Name: 1-(4-methoxyphenyl)-2-[(1-prop-2-enyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanone Openeye Name: 2-(1-allyltetrazol-5-yl)sulfanyl-1-(4-methoxyphenyl)ethanone CAS Name: 1-(4-methoxyphenyl)-2-[(1-prop-2-enyl-5-tetrazolyl)thio]ethanone IUPAC Name: 1-(4-methoxyphenyl)-2-(1-prop-2-enyltetrazol-5-yl)sulfanylethanone Traditional Name: 2-[(1-allyltetrazol-5-yl)thio]-1-(4-methoxyphenyl)ethanone Formula: C13H14N4O2S MolecularWeight: 290.34086

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CSC2=NN=NN2CC=C

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CSC2=NN=NN2CC=C

InChI

InChI=1S/C13H14N4O2S/c1-3-8-17-13(14-15-16-17)20-9-12(18)10-4-6-11(19-2)7-5-10/h3-7H,1,8-9H2,2H3