2-(2-carbamothioyl-3-oxidanylidene-5-phenyl-1H-pyrazol-4-yl)ethylazanium

Systemtic Name: 2-(2-carbamothioyl-3-oxidanylidene-5-phenyl-1H-pyrazol-4-yl)ethylazanium Openeye Name: 2-(2-carbamothioyl-3-oxo-5-phenyl-1H-pyrazol-4-yl)ethylammonium CAS Name: 2-(2-carbamothioyl-3-oxo-5-phenyl-1H-pyrazol-4-yl)ethylammonium IUPAC Name: 2-(2-carbamothioyl-3-oxo-5-phenyl-1H-pyrazol-4-yl)ethylazanium Traditional Name: 2-(5-keto-3-phenyl-1-thiocarbamoyl-3-pyrazolin-4-yl)ethylammonium Formula: C12H15N4OS+ MolecularWeight: 263.3387

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)N(N2)C(=S)N)CC[NH3+]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)N(N2)C(=S)N)CC[NH3+]

InChI

InChI=1S/C12H14N4OS/c13-7-6-9-10(8-4-2-1-3-5-8)15-16(11(9)17)12(14)18/h1-5,15H,6-7,13H2,(H2,14,18)/p+1