ethyl-dimethyl-(3-pyrido[3,2-b][1,4]benzothiazin-10-ylpropyl)azanium; ethyl sulfate

Systemtic Name: ethyl-dimethyl-(3-pyrido[3,2-b][1,4]benzothiazin-10-ylpropyl)azanium; ethyl sulfate Openeye Name: ethyl-dimethyl-(3-pyrido[3,2-b][1,4]benzothiazin-10-ylpropyl)ammonium; ethyl sulfate CAS Name: ethyl-dimethyl-[3-(10-pyrido[3,2-b][1,4]benzothiazinyl)propyl]ammonium; ethyl sulfate IUPAC Name: ethyl-dimethyl-(3-pyrido[3,2-b][1,4]benzothiazin-10-ylpropyl)azanium; ethyl sulfate Traditional Name: ethyl-dimethyl-(3-pyrido[3,2-b][1,4]benzothiazin-10-ylpropyl)ammonium; ethyl sulfate Formula: C20H29N3O4S2 MolecularWeight: 439.59196

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(C)CCCN1C2=CC=CC=C2SC3=C1N=CC=C3.CCOS(=O)(=O)[O-]

Isomeric SMILES

CC[N+](C)(C)CCCN1C2=CC=CC=C2SC3=C1N=CC=C3.CCOS(=O)(=O)[O-]

InChI

InChI=1S/C18H24N3S.C2H6O4S/c1-4-21(2,3)14-8-13-20-15-9-5-6-10-16(15)22-17-11-7-12-19-18(17)20;1-2-6-7(3,4)5/h5-7,9-12H,4,8,13-14H2,1-3H3;2H2,1H3,(H,3,4,5)/q+1;/p-1