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

Systemtic Name: 3-[(4-azanyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]propylazanium Openeye Name: 3-[(4-amino-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]propylammonium CAS Name: 3-[(4-amino-5-phenyl-1,2,4-triazol-3-yl)thio]propylammonium IUPAC Name: 3-[(4-amino-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]propylazanium Traditional Name: 3-[(4-amino-5-phenyl-1,2,4-triazol-3-yl)thio]propylammonium Formula: C11H16N5S+ MolecularWeight: 250.34324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(N2N)SCCC[NH3+]

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(N2N)SCCC[NH3+]

InChI

InChI=1S/C11H15N5S/c12-7-4-8-17-11-15-14-10(16(11)13)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8,12-13H2/p+1