4-cyclopropyl-5-pyridin-4-yl-2-[[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]-1,2,4-triazole-3-thione

Systemtic Name: 4-cyclopropyl-5-pyridin-4-yl-2-[[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]-1,2,4-triazole-3-thione Openeye Name: 4-cyclopropyl-5-(4-pyridyl)-2-[[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]methyl]-1,2,4-triazole-3-thione CAS Name: 4-cyclopropyl-5-pyridin-4-yl-2-[[(2R)-2-thiophen-2-yl-1-pyrrolidin-1-iumyl]methyl]-1,2,4-triazole-3-thione IUPAC Name: 4-cyclopropyl-5-pyridin-4-yl-2-[[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]-1,2,4-triazole-3-thione Traditional Name: 4-cyclopropyl-5-(4-pyridyl)-2-[[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]methyl]-1,2,4-triazole-3-thione Formula: C19H22N5S2+ MolecularWeight: 384.54148

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CN2C(=S)N(C(=N2)C3=CC=NC=C3)C4CC4)C5=CC=CS5

Isomeric SMILES

C1C[C@@H]([NH+](C1)CN2C(=S)N(C(=N2)C3=CC=NC=C3)C4CC4)C5=CC=CS5

InChI

InChI=1S/C19H21N5S2/c25-19-23(13-22-11-1-3-16(22)17-4-2-12-26-17)21-18(24(19)15-5-6-15)14-7-9-20-10-8-14/h2,4,7-10,12,15-16H,1,3,5-6,11,13H2/p+1/t16-/m1/s1