3-[(5-cyclopentyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propylazanium

Systemtic Name: 3-[(5-cyclopentyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propylazanium Openeye Name: 3-[(5-cyclopentyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propylammonium CAS Name: 3-[(5-cyclopentyl-4-phenyl-1,2,4-triazol-3-yl)thio]propylammonium IUPAC Name: 3-[(5-cyclopentyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propylazanium Traditional Name: 3-[(5-cyclopentyl-4-phenyl-1,2,4-triazol-3-yl)thio]propylammonium Formula: C16H23N4S+ MolecularWeight: 303.44562

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C2=NN=C(N2C3=CC=CC=C3)SCCC[NH3+]

Isomeric SMILES

C1CCC(C1)C2=NN=C(N2C3=CC=CC=C3)SCCC[NH3+]

InChI

InChI=1S/C16H22N4S/c17-11-6-12-21-16-19-18-15(13-7-4-5-8-13)20(16)14-9-2-1-3-10-14/h1-3,9-10,13H,4-8,11-12,17H2/p+1