1,4-bis(4-methylpiperazin-1-yl)-5,5-bis(oxidanylidene)phenothiazin-3-one

Systemtic Name: 1,4-bis(4-methylpiperazin-1-yl)-5,5-bis(oxidanylidene)phenothiazin-3-one Openeye Name: 1,4-bis(4-methylpiperazin-1-yl)-5,5-dioxo-phenothiazin-3-one CAS Name: 1,4-bis(4-methyl-1-piperazinyl)-5,5-dioxo-3-phenothiazinone IUPAC Name: 1,4-bis(4-methylpiperazin-1-yl)-5,5-dioxophenothiazin-3-one Traditional Name: 5,5-diketo-1,4-bis(4-methylpiperazino)phenothiazin-3-one Formula: C22H27N5O3S MolecularWeight: 441.54648

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC(=O)C(=C3C2=NC4=CC=CC=C4S3(=O)=O)N5CCN(CC5)C

Isomeric SMILES

CN1CCN(CC1)C2=CC(=O)C(=C3C2=NC4=CC=CC=C4S3(=O)=O)N5CCN(CC5)C

InChI

InChI=1S/C22H27N5O3S/c1-24-7-11-26(12-8-24)17-15-18(28)21(27-13-9-25(2)10-14-27)22-20(17)23-16-5-3-4-6-19(16)31(22,29)30/h3-6,15H,7-14H2,1-2H3