2-methylsulfanyl-10-[3-(oxan-2-yloxy)propyl]phenothiazine

Systemtic Name: 2-methylsulfanyl-10-[3-(oxan-2-yloxy)propyl]phenothiazine Openeye Name: 2-methylsulfanyl-10-(3-tetrahydropyran-2-yloxypropyl)phenothiazine CAS Name: 2-(methylthio)-10-[3-(2-oxanyloxy)propyl]phenothiazine IUPAC Name: 2-methylsulfanyl-10-[3-(oxan-2-yloxy)propyl]phenothiazine Traditional Name: 2-(methylthio)-10-(3-tetrahydropyran-2-yloxypropyl)phenothiazine Formula: C21H25NO2S2 MolecularWeight: 387.5587

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCOC4CCCCO4

Isomeric SMILES

CSC1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCOC4CCCCO4

InChI

InChI=1S/C21H25NO2S2/c1-25-16-10-11-20-18(15-16)22(17-7-2-3-8-19(17)26-20)12-6-14-24-21-9-4-5-13-23-21/h2-3,7-8,10-11,15,21H,4-6,9,12-14H2,1H3