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4-methoxybutyl-methyl-(methylaminosulfanylcarbonyl)-[2-phenyl-3-(sulfonylamino)propanoyl]azanium

4-methoxybutyl-methyl-(methylaminosulfanylcarbonyl)-[2-phenyl-3-(sulfonylamino)propanoyl]azanium

Systemtic Name:4-methoxybutyl-methyl-(methylaminosulfanylcarbonyl)-[2-phenyl-3-(sulfonylamino)propanoyl]azanium
Openeye Name:4-methoxybutyl-methyl-(methylaminosulfanylcarbonyl)-[2-phenyl-3-(sulfonylamino)propanoyl]ammonium
CAS Name:4-methoxybutyl-methyl-[(methylaminothio)-oxomethyl]-[1-oxo-2-phenyl-3-(sulfonylamino)propyl]ammonium
IUPAC Name:4-methoxybutyl-methyl-(methylaminosulfanylcarbonyl)-[2-phenyl-3-(sulfonylamino)propanoyl]azanium
Traditional Name:4-methoxybutyl-methyl-(methylaminothio)carbonyl-[2-phenyl-3-(sulfonylamino)propanoyl]ammonium
Formula: C17H26N3O5S2+
MolecularWeight: 416.53544
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Descriptors Computed from Structure

Canonical SMILES:

CNSC(=O)[N+](C)(CCCCOC)C(=O)C(CN=S(=O)=O)C1=CC=CC=C1


Isomeric SMILES

CNSC(=O)[N+](C)(CCCCOC)C(=O)C(CN=S(=O)=O)C1=CC=CC=C1


InChI

InChI=1S/C17H26N3O5S2/c1-18-26-17(22)20(2,11-7-8-12-25-3)16(21)15(13-19-27(23)24)14-9-5-4-6-10-14/h4-6,9-10,15,18H,7-8,11-13H2,1-3H3/q+1


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