(2-ethylsulfanylpyrimidin-5-yl)methyl-[(3-methylthiophen-2-yl)methyl]-[(2S)-2-oxidanylpropyl]azanium

Systemtic Name: (2-ethylsulfanylpyrimidin-5-yl)methyl-[(3-methylthiophen-2-yl)methyl]-[(2S)-2-oxidanylpropyl]azanium Openeye Name: (2-ethylsulfanylpyrimidin-5-yl)methyl-[(2S)-2-hydroxypropyl]-[(3-methyl-2-thienyl)methyl]ammonium CAS Name: [2-(ethylthio)-5-pyrimidinyl]methyl-[(2S)-2-hydroxypropyl]-[(3-methyl-2-thiophenyl)methyl]ammonium IUPAC Name: (2-ethylsulfanylpyrimidin-5-yl)methyl-[(2S)-2-hydroxypropyl]-[(3-methylthiophen-2-yl)methyl]azanium Traditional Name: [2-(ethylthio)pyrimidin-5-yl]methyl-[(2S)-2-hydroxypropyl]-[(3-methyl-2-thienyl)methyl]ammonium Formula: C16H24N3OS2+ MolecularWeight: 338.51126

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC=C(C=N1)C[NH+](CC2=C(C=CS2)C)CC(C)O

Isomeric SMILES

CCSC1=NC=C(C=N1)C[NH+](CC2=C(C=CS2)C)C[C@H](C)O

InChI

InChI=1S/C16H23N3OS2/c1-4-21-16-17-7-14(8-18-16)10-19(9-13(3)20)11-15-12(2)5-6-22-15/h5-8,13,20H,4,9-11H2,1-3H3/p+1/t13-/m0/s1