1-(2-chloranylphenothiazin-10-yl)-3-(4-methylpiperazine-1,4-diium-1-yl)propan-1-one

Systemtic Name: 1-(2-chloranylphenothiazin-10-yl)-3-(4-methylpiperazine-1,4-diium-1-yl)propan-1-one Openeye Name: 1-(2-chlorophenothiazin-10-yl)-3-(4-methylpiperazine-1,4-diium-1-yl)propan-1-one CAS Name: 1-(2-chloro-10-phenothiazinyl)-3-(4-methyl-1-piperazine-1,4-diiumyl)-1-propanone IUPAC Name: 1-(2-chlorophenothiazin-10-yl)-3-(4-methylpiperazine-1,4-diium-1-yl)propan-1-one Traditional Name: 1-(2-chlorophenothiazin-10-yl)-3-(4-methylpiperazine-1,4-diium-1-yl)propan-1-one Formula: C20H24ClN3OS+2 MolecularWeight: 389.94206

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CCC(=O)N2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CCC(=O)N2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl

InChI

InChI=1S/C20H22ClN3OS/c1-22-10-12-23(13-11-22)9-8-20(25)24-16-4-2-3-5-18(16)26-19-7-6-15(21)14-17(19)24/h2-7,14H,8-13H2,1H3/p+2