N-naphthalen-2-yl-N'-[(Z)-C-phenyl-N-(trimethylazaniumyl)carbonimidoyl]carbamimidothioate

Systemtic Name: N-naphthalen-2-yl-N'-[(Z)-C-phenyl-N-(trimethylazaniumyl)carbonimidoyl]carbamimidothioate Openeye Name: N-(2-naphthyl)-N'-[(Z)-C-phenyl-N-(trimethylammonio)carbonimidoyl]carbamimidothioate CAS Name: N-(2-naphthalenyl)-N'-[(Z)-phenyl-(trimethylammonio)iminomethyl]carbamimidothioate IUPAC Name: N-naphthalen-2-yl-N'-[(Z)-C-phenyl-N-(trimethylazaniumyl)carbonimidoyl]carbamimidothioate Traditional Name: N-(2-naphthyl)-N'-[(Z)-C-phenyl-N-(trimethylammonio)carbonimidoyl]carbamimidothioate Formula: C21H22N4S MolecularWeight: 362.49118

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)N=C(C1=CC=CC=C1)N=C(NC2=CC3=CC=CC=C3C=C2)[S-]

Isomeric SMILES

C[N+](C)(C)/N=C(/C1=CC=CC=C1)\N=C(NC2=CC3=CC=CC=C3C=C2)[S-]

InChI

InChI=1S/C21H22N4S/c1-25(2,3)24-20(17-10-5-4-6-11-17)23-21(26)22-19-14-13-16-9-7-8-12-18(16)15-19/h4-15H,1-3H3,(H-,22,23,24,26)