10-(1-pyrrolidin-1-ium-1-ylpropan-2-yl)phenothiazine-2-carboximidamide iodide hydrochloride

Systemtic Name: 10-(1-pyrrolidin-1-ium-1-ylpropan-2-yl)phenothiazine-2-carboximidamide iodide hydrochloride Openeye Name: 10-(1-methyl-2-pyrrolidin-1-ium-1-yl-ethyl)phenothiazine-2-carboxamidine iodide hydrochloride CAS Name: 10-[1-(1-pyrrolidin-1-iumyl)propan-2-yl]-2-phenothiazinecarboximidamide iodide hydrochloride IUPAC Name: 10-(1-pyrrolidin-1-ium-1-ylpropan-2-yl)phenothiazine-2-carboximidamide iodide hydrochloride Traditional Name: 10-(1-methyl-2-pyrrolidin-1-ium-1-yl-ethyl)phenothiazine-2-carboxamidine iodide hydrochloride Formula: C20H26ClIN4S MolecularWeight: 516.86971

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH+]1CCCC1)N2C3=CC=CC=C3SC4=C2C=C(C=C4)C(=N)N.Cl.[I-]

Isomeric SMILES

CC(C[NH+]1CCCC1)N2C3=CC=CC=C3SC4=C2C=C(C=C4)C(=N)N.Cl.[I-]

InChI

InChI=1S/C20H24N4S.ClH.HI/c1-14(13-23-10-4-5-11-23)24-16-6-2-3-7-18(16)25-19-9-8-15(20(21)22)12-17(19)24;;/h2-3,6-9,12,14H,4-5,10-11,13H2,1H3,(H3,21,22);2*1H