N-[3-[2-chloranyl-7-(oxan-2-yloxy)-5-oxidanylidene-phenothiazin-10-yl]propyl]-N-methyl-methanamide

Systemtic Name: N-[3-[2-chloranyl-7-(oxan-2-yloxy)-5-oxidanylidene-phenothiazin-10-yl]propyl]-N-methyl-methanamide Openeye Name: N-[3-(2-chloro-5-oxo-7-tetrahydropyran-2-yloxy-phenothiazin-10-yl)propyl]-N-methyl-formamide CAS Name: N-[3-[2-chloro-7-(2-oxanyloxy)-5-oxo-10-phenothiazinyl]propyl]-N-methylformamide IUPAC Name: N-[3-[2-chloro-7-(oxan-2-yloxy)-5-oxophenothiazin-10-yl]propyl]-N-methylformamide Traditional Name: N-[3-(2-chloro-5-keto-7-tetrahydropyran-2-yloxy-phenothiazin-10-yl)propyl]-N-methyl-formamide Formula: C22H25ClN2O4S MolecularWeight: 448.9629

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCN1C2=C(C=C(C=C2)OC3CCCCO3)S(=O)C4=C1C=C(C=C4)Cl)C=O

Isomeric SMILES

CN(CCCN1C2=C(C=C(C=C2)OC3CCCCO3)S(=O)C4=C1C=C(C=C4)Cl)C=O

InChI

InChI=1S/C22H25ClN2O4S/c1-24(15-26)10-4-11-25-18-8-7-17(29-22-5-2-3-12-28-22)14-21(18)30(27)20-9-6-16(23)13-19(20)25/h6-9,13-15,22H,2-5,10-12H2,1H3