3-[[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-1,3,4-thiadiazole-2-thione

Systemtic Name: 3-[[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-1,3,4-thiadiazole-2-thione Openeye Name: 3-[[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-1,3,4-thiadiazole-2-thione CAS Name: 3-[[(2R)-2-(4-methoxyphenyl)-1-pyrrolidin-1-iumyl]methyl]-1,3,4-thiadiazole-2-thione IUPAC Name: 3-[[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-1,3,4-thiadiazole-2-thione Traditional Name: 3-[[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-1,3,4-thiadiazole-2-thione Formula: C14H18N3OS2+ MolecularWeight: 308.44222

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCC[NH+]2CN3C(=S)SC=N3

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2CCC[NH+]2CN3C(=S)SC=N3

InChI

InChI=1S/C14H17N3OS2/c1-18-12-6-4-11(5-7-12)13-3-2-8-16(13)10-17-14(19)20-9-15-17/h4-7,9,13H,2-3,8,10H2,1H3/p+1/t13-/m1/s1