[(1S)-1-[4-butyl-5-(9H-fluoren-9-ylsulfanyl)-1,2,4-triazol-3-yl]propyl]-dimethyl-azanium

Systemtic Name: [(1S)-1-[4-butyl-5-(9H-fluoren-9-ylsulfanyl)-1,2,4-triazol-3-yl]propyl]-dimethyl-azanium Openeye Name: [(1S)-1-[4-butyl-5-(9H-fluoren-9-ylsulfanyl)-1,2,4-triazol-3-yl]propyl]-dimethyl-ammonium CAS Name: [(1S)-1-[4-butyl-5-(9H-fluoren-9-ylthio)-1,2,4-triazol-3-yl]propyl]-dimethylammonium IUPAC Name: [(1S)-1-[4-butyl-5-(9H-fluoren-9-ylsulfanyl)-1,2,4-triazol-3-yl]propyl]-dimethylazanium Traditional Name: [(1S)-1-[4-butyl-5-(9H-fluoren-9-ylthio)-1,2,4-triazol-3-yl]propyl]-dimethyl-ammonium Formula: C24H31N4S+ MolecularWeight: 407.59474

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=C1SC2C3=CC=CC=C3C4=CC=CC=C24)C(CC)[NH+](C)C

Isomeric SMILES

CCCCN1C(=NN=C1SC2C3=CC=CC=C3C4=CC=CC=C24)[C@H](CC)[NH+](C)C

InChI

InChI=1S/C24H30N4S/c1-5-7-16-28-23(21(6-2)27(3)4)25-26-24(28)29-22-19-14-10-8-12-17(19)18-13-9-11-15-20(18)22/h8-15,21-22H,5-7,16H2,1-4H3/p+1/t21-/m0/s1