3-methyl-2-(2-methylphenyl)-10-[1-(1-methylpyrrolidin-1-ium-1-yl)propan-2-yl]phenothiazine-1-carboxamide

Systemtic Name: 3-methyl-2-(2-methylphenyl)-10-[1-(1-methylpyrrolidin-1-ium-1-yl)propan-2-yl]phenothiazine-1-carboxamide Openeye Name: 3-methyl-10-[1-methyl-2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]-2-(o-tolyl)phenothiazine-1-carboxamide CAS Name: 3-methyl-2-(2-methylphenyl)-10-[1-(1-methyl-1-pyrrolidin-1-iumyl)propan-2-yl]-1-phenothiazinecarboxamide IUPAC Name: 3-methyl-2-(2-methylphenyl)-10-[1-(1-methylpyrrolidin-1-ium-1-yl)propan-2-yl]phenothiazine-1-carboxamide Traditional Name: 3-methyl-10-[1-methyl-2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]-2-(o-tolyl)phenothiazine-1-carboxamide Formula: C29H34N3OS+ MolecularWeight: 472.66476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(C3=C(C=C2C)SC4=CC=CC=C4N3C(C)C[N+]5(CCCC5)C)C(=O)N

Isomeric SMILES

CC1=CC=CC=C1C2=C(C3=C(C=C2C)SC4=CC=CC=C4N3C(C)C[N+]5(CCCC5)C)C(=O)N

InChI

InChI=1S/C29H33N3OS/c1-19-11-5-6-12-22(19)26-20(2)17-25-28(27(26)29(30)33)31(23-13-7-8-14-24(23)34-25)21(3)18-32(4)15-9-10-16-32/h5-8,11-14,17,21H,9-10,15-16,18H2,1-4H3,(H-,30,33)/p+1