3-methyl-4-[3-[methyl(pyrrolidin-1-yl)amino]propyl]-2-phenyl-1H-1,2,4-triazol-4-ium-5-thione

Systemtic Name: 3-methyl-4-[3-[methyl(pyrrolidin-1-yl)amino]propyl]-2-phenyl-1H-1,2,4-triazol-4-ium-5-thione Openeye Name: 3-methyl-4-[3-[methyl(pyrrolidin-1-yl)amino]propyl]-2-phenyl-1H-1,2,4-triazol-4-ium-5-thione CAS Name: 3-methyl-4-[3-[methyl(1-pyrrolidinyl)amino]propyl]-2-phenyl-1H-1,2,4-triazol-4-ium-5-thione IUPAC Name: 3-methyl-4-[3-[methyl(pyrrolidin-1-yl)amino]propyl]-2-phenyl-1H-1,2,4-triazol-4-ium-5-thione Traditional Name: 3-methyl-4-[3-[methyl(pyrrolidino)amino]propyl]-2-phenyl-1H-1,2,4-triazol-4-ium-5-thione Formula: C17H26N5S+ MolecularWeight: 332.48684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=S)NN1C2=CC=CC=C2)CCCN(C)N3CCCC3

Isomeric SMILES

CC1=[N+](C(=S)NN1C2=CC=CC=C2)CCCN(C)N3CCCC3

InChI

InChI=1S/C17H25N5S/c1-15-21(14-8-11-19(2)20-12-6-7-13-20)17(23)18-22(15)16-9-4-3-5-10-16/h3-5,9-10H,6-8,11-14H2,1-2H3/p+1