4-(4-methylthiomorpholin-4-ium-4-yl)-2,2-diphenyl-butanamide iodide

Systemtic Name: 4-(4-methylthiomorpholin-4-ium-4-yl)-2,2-diphenyl-butanamide iodide Openeye Name: 4-(4-methylthiomorpholin-4-ium-4-yl)-2,2-diphenyl-butanamide iodide CAS Name: 4-(4-methyl-4-thiomorpholin-4-iumyl)-2,2-diphenylbutanamide iodide IUPAC Name: 4-(4-methylthiomorpholin-4-ium-4-yl)-2,2-diphenylbutanamide iodide Traditional Name: 4-(4-methylthiomorpholin-4-ium-4-yl)-2,2-diphenyl-butyramide iodide Formula: C21H27IN2OS MolecularWeight: 482.42135

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCSCC1)CCC(C2=CC=CC=C2)(C3=CC=CC=C3)C(=O)N.[I-]

Isomeric SMILES

C[N+]1(CCSCC1)CCC(C2=CC=CC=C2)(C3=CC=CC=C3)C(=O)N.[I-]

InChI

InChI=1S/C21H26N2OS.HI/c1-23(14-16-25-17-15-23)13-12-21(20(22)24,18-8-4-2-5-9-18)19-10-6-3-7-11-19;/h2-11H,12-17H2,1H3,(H-,22,24);1H