4-(3-chlorophenyl)-3-pyrrolidin-1-ium-1-yl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(3-chlorophenyl)-3-pyrrolidin-1-ium-1-yl-1H-1,2,4-triazole-5-thione Openeye Name: 4-(3-chlorophenyl)-3-pyrrolidin-1-ium-1-yl-1H-1,2,4-triazole-5-thione CAS Name: 4-(3-chlorophenyl)-3-(1-pyrrolidin-1-iumyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(3-chlorophenyl)-3-pyrrolidin-1-ium-1-yl-1H-1,2,4-triazole-5-thione Traditional Name: 4-(3-chlorophenyl)-3-pyrrolidin-1-ium-1-yl-1H-1,2,4-triazole-5-thione Formula: C12H14ClN4S+ MolecularWeight: 281.78436

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C2=NNC(=S)N2C3=CC(=CC=C3)Cl

Isomeric SMILES

C1CC[NH+](C1)C2=NNC(=S)N2C3=CC(=CC=C3)Cl

InChI

InChI=1S/C12H13ClN4S/c13-9-4-3-5-10(8-9)17-11(14-15-12(17)18)16-6-1-2-7-16/h3-5,8H,1-2,6-7H2,(H,15,18)/p+1