2-[2-[3-[2-(2-fluoranylphenoxy)ethyl-methyl-amino]propoxy]-5-methoxy-phenyl]-4-methyl-1,4-benzothiazin-3-one hydrochloride

Systemtic Name: 2-[2-[3-[2-(2-fluoranylphenoxy)ethyl-methyl-amino]propoxy]-5-methoxy-phenyl]-4-methyl-1,4-benzothiazin-3-one hydrochloride Openeye Name: 2-[2-[3-[2-(2-fluorophenoxy)ethyl-methyl-amino]propoxy]-5-methoxy-phenyl]-4-methyl-1,4-benzothiazin-3-one hydrochloride CAS Name: 2-[2-[3-[2-(2-fluorophenoxy)ethyl-methylamino]propoxy]-5-methoxyphenyl]-4-methyl-1,4-benzothiazin-3-one hydrochloride IUPAC Name: 2-[2-[3-[2-(2-fluorophenoxy)ethyl-methylamino]propoxy]-5-methoxyphenyl]-4-methyl-1,4-benzothiazin-3-one hydrochloride Traditional Name: 2-[2-[3-[2-(2-fluorophenoxy)ethyl-methyl-amino]propoxy]-5-methoxy-phenyl]-4-methyl-1,4-benzothiazin-3-one hydrochloride Formula: C28H32ClFN2O4S MolecularWeight: 547.081083

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2SC(C1=O)C3=C(C=CC(=C3)OC)OCCCN(C)CCOC4=CC=CC=C4F.Cl

Isomeric SMILES

CN1C2=CC=CC=C2SC(C1=O)C3=C(C=CC(=C3)OC)OCCCN(C)CCOC4=CC=CC=C4F.Cl

InChI

InChI=1S/C28H31FN2O4S.ClH/c1-30(16-18-35-25-11-6-4-9-22(25)29)15-8-17-34-24-14-13-20(33-3)19-21(24)27-28(32)31(2)23-10-5-7-12-26(23)36-27;/h4-7,9-14,19,27H,8,15-18H2,1-3H3;1H