N-[2-methyl-1-[(2S,3S,4R,5S,6S)-6-methylsulfanyl-3,4,5-tris(oxidanyl)oxan-2-yl]propyl]-3-propyl-azetidine-2-carboxamide

Systemtic Name: N-[2-methyl-1-[(2S,3S,4R,5S,6S)-6-methylsulfanyl-3,4,5-tris(oxidanyl)oxan-2-yl]propyl]-3-propyl-azetidine-2-carboxamide Openeye Name: N-[2-methyl-1-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methylsulfanyl-tetrahydropyran-2-yl]propyl]-3-propyl-azetidine-2-carboxamide CAS Name: N-[2-methyl-1-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-(methylthio)-2-oxanyl]propyl]-3-propyl-2-azetidinecarboxamide IUPAC Name: N-[2-methyl-1-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methylsulfanyloxan-2-yl]propyl]-3-propylazetidine-2-carboxamide Traditional Name: N-[2-methyl-1-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-(methylthio)tetrahydropyran-2-yl]propyl]-3-propyl-azetidine-2-carboxamide Formula: C17H32N2O5S MolecularWeight: 376.51138

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CNC1C(=O)NC(C2C(C(C(C(O2)SC)O)O)O)C(C)C

Isomeric SMILES

CCCC1CNC1C(=O)NC([C@H]2[C@H]([C@H]([C@@H]([C@@H](O2)SC)O)O)O)C(C)C

InChI

InChI=1S/C17H32N2O5S/c1-5-6-9-7-18-11(9)16(23)19-10(8(2)3)15-13(21)12(20)14(22)17(24-15)25-4/h8-15,17-18,20-22H,5-7H2,1-4H3,(H,19,23)/t9?,10?,11?,12-,13+,14+,15+,17+/m1/s1