4-bromanyl-7-methoxy-2-(4-methylpiperazin-1-yl)phenothiazin-3-one

Systemtic Name: 4-bromanyl-7-methoxy-2-(4-methylpiperazin-1-yl)phenothiazin-3-one Openeye Name: 4-bromo-7-methoxy-2-(4-methylpiperazin-1-yl)phenothiazin-3-one CAS Name: 4-bromo-7-methoxy-2-(4-methyl-1-piperazinyl)-3-phenothiazinone IUPAC Name: 4-bromo-7-methoxy-2-(4-methylpiperazin-1-yl)phenothiazin-3-one Traditional Name: 4-bromo-7-methoxy-2-(4-methylpiperazino)phenothiazin-3-one Formula: C18H18BrN3O2S MolecularWeight: 420.32342

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC3=NC4=C(C=C(C=C4)OC)SC3=C(C2=O)Br

Isomeric SMILES

CN1CCN(CC1)C2=CC3=NC4=C(C=C(C=C4)OC)SC3=C(C2=O)Br

InChI

InChI=1S/C18H18BrN3O2S/c1-21-5-7-22(8-6-21)14-10-13-18(16(19)17(14)23)25-15-9-11(24-2)3-4-12(15)20-13/h3-4,9-10H,5-8H2,1-2H3