dimethylcarbamoyl-(C-methoxycarbonimidoyl)-[(4-nitrophenyl)sulfanylcarbamoyl]-propyl-azanium

Systemtic Name: dimethylcarbamoyl-(C-methoxycarbonimidoyl)-[(4-nitrophenyl)sulfanylcarbamoyl]-propyl-azanium Openeye Name: dimethylcarbamoyl-(methoxycarbonimidoyl)-[(4-nitrophenyl)sulfanylcarbamoyl]-propyl-ammonium CAS Name: [dimethylamino(oxo)methyl]-[imino(methoxy)methyl]-[[[(4-nitrophenyl)thio]amino]-oxomethyl]-propylammonium IUPAC Name: dimethylcarbamoyl-(C-methoxycarbonimidoyl)-[(4-nitrophenyl)sulfanylcarbamoyl]-propylazanium Traditional Name: dimethylcarbamoyl-(methoxycarbonimidoyl)-[[(4-nitrophenyl)thio]carbamoyl]-propyl-ammonium Formula: C15H22N5O5S+ MolecularWeight: 384.43068

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+](C(=N)OC)(C(=O)NSC1=CC=C(C=C1)[N+](=O)[O-])C(=O)N(C)C

Isomeric SMILES

CCC[N+](C(=N)OC)(C(=O)NSC1=CC=C(C=C1)[N+](=O)[O-])C(=O)N(C)C

InChI

InChI=1S/C15H21N5O5S/c1-5-10-20(13(16)25-4,15(22)18(2)3)14(21)17-26-12-8-6-11(7-9-12)19(23)24/h6-9,16H,5,10H2,1-4H3/p+1