(Z)-(carbamothioylhydrazinylidene)-phenethyloxycarbonyl-propan-2-yl-azanium

Systemtic Name: (Z)-(carbamothioylhydrazinylidene)-phenethyloxycarbonyl-propan-2-yl-azanium Openeye Name: (Z)-(carbamothioylhydrazono)-isopropyl-phenethyloxycarbonyl-ammonium CAS Name: (Z)-(carbamothioylhydrazinylidene)-[oxo(phenethyloxy)methyl]-propan-2-ylammonium IUPAC Name: (Z)-(carbamothioylhydrazinylidene)-phenethyloxycarbonyl-propan-2-ylazanium Traditional Name: (Z)-isopropyl-phenethyloxycarbonyl-(thiocarbamoylhydrazono)ammonium Formula: C13H19N4O2S+ MolecularWeight: 295.38056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+](=NNC(=S)N)C(=O)OCCC1=CC=CC=C1

Isomeric SMILES

CC(C)/[N+](=N/NC(=S)N)/C(=O)OCCC1=CC=CC=C1

InChI

InChI=1S/C13H18N4O2S/c1-10(2)17(16-15-12(14)20)13(18)19-9-8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3,(H2,14,20)/p+1