N-(2-cyclobutylethyl)-10-[1-(1-methylpyrrolidin-1-ium-1-yl)propan-2-yl]phenothiazine-1-carboxamide iodide

Systemtic Name: N-(2-cyclobutylethyl)-10-[1-(1-methylpyrrolidin-1-ium-1-yl)propan-2-yl]phenothiazine-1-carboxamide iodide Openeye Name: N-(2-cyclobutylethyl)-10-[1-methyl-2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]phenothiazine-1-carboxamide iodide CAS Name: N-(2-cyclobutylethyl)-10-[1-(1-methyl-1-pyrrolidin-1-iumyl)propan-2-yl]-1-phenothiazinecarboxamide iodide IUPAC Name: N-(2-cyclobutylethyl)-10-[1-(1-methylpyrrolidin-1-ium-1-yl)propan-2-yl]phenothiazine-1-carboxamide iodide Traditional Name: N-(2-cyclobutylethyl)-10-[1-methyl-2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]phenothiazine-1-carboxamide iodide Formula: C27H36IN3OS MolecularWeight: 577.56371

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[N+]1(CCCC1)C)N2C3=CC=CC=C3SC4=CC=CC(=C42)C(=O)NCCC5CCC5.[I-]

Isomeric SMILES

CC(C[N+]1(CCCC1)C)N2C3=CC=CC=C3SC4=CC=CC(=C42)C(=O)NCCC5CCC5.[I-]

InChI

InChI=1S/C27H35N3OS.HI/c1-20(19-30(2)17-5-6-18-30)29-23-12-3-4-13-24(23)32-25-14-8-11-22(26(25)29)27(31)28-16-15-21-9-7-10-21;/h3-4,8,11-14,20-21H,5-7,9-10,15-19H2,1-2H3;1H