(2R)-4-[(2-methylsulfanylpyrimidin-5-yl)methyl]-2-(3-phenylpropyl)morpholin-4-ium

Systemtic Name: (2R)-4-[(2-methylsulfanylpyrimidin-5-yl)methyl]-2-(3-phenylpropyl)morpholin-4-ium Openeye Name: (2R)-4-[(2-methylsulfanylpyrimidin-5-yl)methyl]-2-(3-phenylpropyl)morpholin-4-ium CAS Name: (2R)-4-[[2-(methylthio)-5-pyrimidinyl]methyl]-2-(3-phenylpropyl)morpholin-4-ium IUPAC Name: (2R)-4-[(2-methylsulfanylpyrimidin-5-yl)methyl]-2-(3-phenylpropyl)morpholin-4-ium Traditional Name: (2R)-4-[[2-(methylthio)pyrimidin-5-yl]methyl]-2-(3-phenylpropyl)morpholin-4-ium Formula: C19H26N3OS+ MolecularWeight: 344.49424

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C=N1)C[NH+]2CCOC(C2)CCCC3=CC=CC=C3

Isomeric SMILES

CSC1=NC=C(C=N1)C[NH+]2CCO[C@@H](C2)CCCC3=CC=CC=C3

InChI

InChI=1S/C19H25N3OS/c1-24-19-20-12-17(13-21-19)14-22-10-11-23-18(15-22)9-5-8-16-6-3-2-4-7-16/h2-4,6-7,12-13,18H,5,8-11,14-15H2,1H3/p+1/t18-/m1/s1