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

Systemtic Name: 4-cyclopropyl-5-pyridin-3-yl-2-[[(2S)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]-1,2,4-triazole-3-thione Openeye Name: 4-cyclopropyl-5-(3-pyridyl)-2-[[(2S)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]methyl]-1,2,4-triazole-3-thione CAS Name: 4-cyclopropyl-5-(3-pyridinyl)-2-[[(2S)-2-thiophen-2-yl-1-pyrrolidin-1-iumyl]methyl]-1,2,4-triazole-3-thione IUPAC Name: 4-cyclopropyl-5-pyridin-3-yl-2-[[(2S)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]-1,2,4-triazole-3-thione Traditional Name: 4-cyclopropyl-5-(3-pyridyl)-2-[[(2S)-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=CN=CC=C3)C4CC4)C5=CC=CS5

Isomeric SMILES

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

InChI

InChI=1S/C19H21N5S2/c25-19-23(13-22-10-2-5-16(22)17-6-3-11-26-17)21-18(24(19)15-7-8-15)14-4-1-9-20-12-14/h1,3-4,6,9,11-12,15-16H,2,5,7-8,10,13H2/p+1/t16-/m0/s1