2-chloranyl-10-[3-[4-(2-methylphenyl)-3,6-dihydro-2H-pyridin-1-yl]propyl]phenothiazine hydrobromide

Systemtic Name: 2-chloranyl-10-[3-[4-(2-methylphenyl)-3,6-dihydro-2H-pyridin-1-yl]propyl]phenothiazine hydrobromide Openeye Name: 2-chloro-10-[3-[4-(o-tolyl)-3,6-dihydro-2H-pyridin-1-yl]propyl]phenothiazine hydrobromide CAS Name: 2-chloro-10-[3-[4-(2-methylphenyl)-3,6-dihydro-2H-pyridin-1-yl]propyl]phenothiazine hydrobromide IUPAC Name: 2-chloro-10-[3-[4-(2-methylphenyl)-3,6-dihydro-2H-pyridin-1-yl]propyl]phenothiazine hydrobromide Traditional Name: 2-chloro-10-[3-[4-(o-tolyl)-3,6-dihydro-2H-pyridin-1-yl]propyl]phenothiazine hydrobromide Formula: C27H28BrClN2S MolecularWeight: 527.94662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CCN(CC2)CCCN3C4=CC=CC=C4SC5=C3C=C(C=C5)Cl.Br

Isomeric SMILES

CC1=CC=CC=C1C2=CCN(CC2)CCCN3C4=CC=CC=C4SC5=C3C=C(C=C5)Cl.Br

InChI

InChI=1S/C27H27ClN2S.BrH/c1-20-7-2-3-8-23(20)21-13-17-29(18-14-21)15-6-16-30-24-9-4-5-10-26(24)31-27-12-11-22(28)19-25(27)30;/h2-5,7-13,19H,6,14-18H2,1H3;1H