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

Systemtic Name: 10-[1-(1-methylpyrrolidin-1-ium-1-yl)propan-2-yl]-N-propyl-phenothiazine-2-carboxamide iodide Openeye Name: 10-[1-methyl-2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]-N-propyl-phenothiazine-2-carboxamide iodide CAS Name: 10-[1-(1-methyl-1-pyrrolidin-1-iumyl)propan-2-yl]-N-propyl-2-phenothiazinecarboxamide iodide IUPAC Name: 10-[1-(1-methylpyrrolidin-1-ium-1-yl)propan-2-yl]-N-propylphenothiazine-2-carboxamide iodide Traditional Name: 10-[1-methyl-2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]-N-propyl-phenothiazine-2-carboxamide iodide Formula: C24H32IN3OS MolecularWeight: 537.49985

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2C(C)C[N+]4(CCCC4)C.[I-]

Isomeric SMILES

CCCNC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2C(C)C[N+]4(CCCC4)C.[I-]

InChI

InChI=1S/C24H31N3OS.HI/c1-4-13-25-24(28)19-11-12-23-21(16-19)26(20-9-5-6-10-22(20)29-23)18(2)17-27(3)14-7-8-15-27;/h5-6,9-12,16,18H,4,7-8,13-15,17H2,1-3H3;1H