N'-cyclohexyl-N-[(Z)-C-phenyl-N-(trimethylazaniumyl)carbonimidoyl]carbamimidothioate

Systemtic Name: N'-cyclohexyl-N-[(Z)-C-phenyl-N-(trimethylazaniumyl)carbonimidoyl]carbamimidothioate Openeye Name: N'-cyclohexyl-N-[(Z)-C-phenyl-N-(trimethylammonio)carbonimidoyl]carbamimidothioate CAS Name: N'-cyclohexyl-N-[(Z)-phenyl-(trimethylammonio)iminomethyl]carbamimidothioate IUPAC Name: N'-cyclohexyl-N-[(Z)-C-phenyl-N-(trimethylazaniumyl)carbonimidoyl]carbamimidothioate Traditional Name: N'-cyclohexyl-N-[(Z)-C-phenyl-N-(trimethylammonio)carbonimidoyl]carbamimidothioate Formula: C17H26N4S MolecularWeight: 318.48014

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)N=C(C1=CC=CC=C1)NC(=NC2CCCCC2)[S-]

Isomeric SMILES

C[N+](C)(C)/N=C(/C1=CC=CC=C1)\NC(=NC2CCCCC2)[S-]

InChI

InChI=1S/C17H26N4S/c1-21(2,3)20-16(14-10-6-4-7-11-14)19-17(22)18-15-12-8-5-9-13-15/h4,6-7,10-11,15H,5,8-9,12-13H2,1-3H3,(H-,18,19,20,22)