(4-butan-2-ylphenyl)-(3-phenyl-1,2,3,4-thiatriazol-3-ium-5-yl)azanide

Systemtic Name: (4-butan-2-ylphenyl)-(3-phenyl-1,2,3,4-thiatriazol-3-ium-5-yl)azanide Openeye Name: (3-phenylthiatriazol-3-ium-5-yl)-(4-sec-butylphenyl)azanide CAS Name: (4-butan-2-ylphenyl)-(3-phenyl-5-thiatriazol-3-iumyl)azanide IUPAC Name: (4-butan-2-ylphenyl)-(3-phenylthiatriazol-3-ium-5-yl)azanide Traditional Name: (3-phenylthiatriazol-3-ium-5-yl)-(4-sec-butylphenyl)azanide Formula: C17H18N4S MolecularWeight: 310.41662

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)[N-]C2=N[N+](=NS2)C3=CC=CC=C3

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)[N-]C2=N[N+](=NS2)C3=CC=CC=C3

InChI

InChI=1S/C17H18N4S/c1-3-13(2)14-9-11-15(12-10-14)18-17-19-21(20-22-17)16-7-5-4-6-8-16/h4-13H,3H2,1-2H3