8-chloranyl-10-[3-(4-methylpiperazin-4-ium-1-yl)propyl]phenothiazin-3-ol

Systemtic Name: 8-chloranyl-10-[3-(4-methylpiperazin-4-ium-1-yl)propyl]phenothiazin-3-ol Openeye Name: 8-chloro-10-[3-(4-methylpiperazin-4-ium-1-yl)propyl]phenothiazin-3-ol CAS Name: 8-chloro-10-[3-(4-methyl-1-piperazin-4-iumyl)propyl]-3-phenothiazinol IUPAC Name: 8-chloro-10-[3-(4-methylpiperazin-4-ium-1-yl)propyl]phenothiazin-3-ol Traditional Name: 8-chloro-10-[3-(4-methylpiperazin-4-ium-1-yl)propyl]phenothiazin-3-ol Formula: C20H25ClN3OS+ MolecularWeight: 390.95

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CCCN2C3=C(C=C(C=C3)O)SC4=C2C=C(C=C4)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)CCCN2C3=C(C=C(C=C3)O)SC4=C2C=C(C=C4)Cl

InChI

InChI=1S/C20H24ClN3OS/c1-22-9-11-23(12-10-22)7-2-8-24-17-5-4-16(25)14-20(17)26-19-6-3-15(21)13-18(19)24/h3-6,13-14,25H,2,7-12H2,1H3/p+1