2-methyl-N-[(2-methylphenyl)methyl]-3-(1-methylpyrrolidin-1-ium-1-yl)-3-phenothiazin-10-yl-propanamide

Systemtic Name: 2-methyl-N-[(2-methylphenyl)methyl]-3-(1-methylpyrrolidin-1-ium-1-yl)-3-phenothiazin-10-yl-propanamide Openeye Name: 2-methyl-3-(1-methylpyrrolidin-1-ium-1-yl)-N-(o-tolylmethyl)-3-phenothiazin-10-yl-propanamide CAS Name: 2-methyl-N-[(2-methylphenyl)methyl]-3-(1-methyl-1-pyrrolidin-1-iumyl)-3-(10-phenothiazinyl)propanamide IUPAC Name: 2-methyl-N-[(2-methylphenyl)methyl]-3-(1-methylpyrrolidin-1-ium-1-yl)-3-phenothiazin-10-ylpropanamide Traditional Name: 2-methyl-N-(2-methylbenzyl)-3-(1-methylpyrrolidin-1-ium-1-yl)-3-phenothiazin-10-yl-propionamide Formula: C29H34N3OS+ MolecularWeight: 472.66476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)C(C)C(N2C3=CC=CC=C3SC4=CC=CC=C42)[N+]5(CCCC5)C

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)C(C)C(N2C3=CC=CC=C3SC4=CC=CC=C42)[N+]5(CCCC5)C

InChI

InChI=1S/C29H33N3OS/c1-21-12-4-5-13-23(21)20-30-28(33)22(2)29(32(3)18-10-11-19-32)31-24-14-6-8-16-26(24)34-27-17-9-7-15-25(27)31/h4-9,12-17,22,29H,10-11,18-20H2,1-3H3/p+1