1-(4-methoxyphenyl)-4-[[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]-1,2,3,4-tetrazole-5-thione

Systemtic Name: 1-(4-methoxyphenyl)-4-[[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]-1,2,3,4-tetrazole-5-thione Openeye Name: 1-(4-methoxyphenyl)-4-[[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]methyl]tetrazole-5-thione CAS Name: 1-(4-methoxyphenyl)-4-[[(2R)-2-thiophen-2-yl-1-pyrrolidin-1-iumyl]methyl]-5-tetrazolethione IUPAC Name: 1-(4-methoxyphenyl)-4-[[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]tetrazole-5-thione Traditional Name: 1-(4-methoxyphenyl)-4-[[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]methyl]tetrazole-5-thione Formula: C17H20N5OS2+ MolecularWeight: 374.5036

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=S)N(N=N2)C[NH+]3CCCC3C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=S)N(N=N2)C[NH+]3CCC[C@@H]3C4=CC=CS4

InChI

InChI=1S/C17H19N5OS2/c1-23-14-8-6-13(7-9-14)22-17(24)21(18-19-22)12-20-10-2-4-15(20)16-5-3-11-25-16/h3,5-9,11,15H,2,4,10,12H2,1H3/p+1/t15-/m1/s1