1-[2,4-bis(chloranyl)-5-methoxy-phenyl]-5-prop-2-ynylsulfanyl-1,2,3,4-tetrazole

Systemtic Name: 1-[2,4-bis(chloranyl)-5-methoxy-phenyl]-5-prop-2-ynylsulfanyl-1,2,3,4-tetrazole Openeye Name: 1-(2,4-dichloro-5-methoxy-phenyl)-5-prop-2-ynylsulfanyl-tetrazole CAS Name: 1-(2,4-dichloro-5-methoxyphenyl)-5-(prop-2-ynylthio)tetrazole IUPAC Name: 1-(2,4-dichloro-5-methoxyphenyl)-5-prop-2-ynylsulfanyltetrazole Traditional Name: 1-(2,4-dichloro-5-methoxy-phenyl)-5-(propargylthio)tetrazole Formula: C11H8Cl2N4OS MolecularWeight: 315.17842

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)N2C(=NN=N2)SCC#C)Cl)Cl

Isomeric SMILES

COC1=C(C=C(C(=C1)N2C(=NN=N2)SCC#C)Cl)Cl

InChI

InChI=1S/C11H8Cl2N4OS/c1-3-4-19-11-14-15-16-17(11)9-6-10(18-2)8(13)5-7(9)12/h1,5-6H,4H2,2H3