(4-bromophenyl)sulfanylcarbamoyl-(dimethylcarbamoyl)-(C-ethoxycarbonimidoyl)-methyl-azanium

Systemtic Name: (4-bromophenyl)sulfanylcarbamoyl-(dimethylcarbamoyl)-(C-ethoxycarbonimidoyl)-methyl-azanium Openeye Name: (4-bromophenyl)sulfanylcarbamoyl-(dimethylcarbamoyl)-(ethoxycarbonimidoyl)-methyl-ammonium CAS Name: [[[(4-bromophenyl)thio]amino]-oxomethyl]-[dimethylamino(oxo)methyl]-[ethoxy(imino)methyl]-methylammonium IUPAC Name: (4-bromophenyl)sulfanylcarbamoyl-(dimethylcarbamoyl)-(C-ethoxycarbonimidoyl)-methylazanium Traditional Name: [(4-bromophenyl)thio]carbamoyl-(dimethylcarbamoyl)-(ethoxycarbonimidoyl)-methyl-ammonium Formula: C14H20BrN4O3S+ MolecularWeight: 404.3026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=N)[N+](C)(C(=O)NSC1=CC=C(C=C1)Br)C(=O)N(C)C

Isomeric SMILES

CCOC(=N)[N+](C)(C(=O)NSC1=CC=C(C=C1)Br)C(=O)N(C)C

InChI

InChI=1S/C14H19BrN4O3S/c1-5-22-12(16)19(4,14(21)18(2)3)13(20)17-23-11-8-6-10(15)7-9-11/h6-9,16H,5H2,1-4H3/p+1