(3S,4R)-3-ethyl-4-[2-(1H-indol-2-yl)-1-oxidanylidene-1,3-dithian-2-yl]-1-methyl-piperidin-3-ol

Systemtic Name: (3S,4R)-3-ethyl-4-[2-(1H-indol-2-yl)-1-oxidanylidene-1,3-dithian-2-yl]-1-methyl-piperidin-3-ol Openeye Name: (3S,4R)-3-ethyl-4-[2-(1H-indol-2-yl)-1-oxo-1,3-dithian-2-yl]-1-methyl-piperidin-3-ol CAS Name: (3S,4R)-3-ethyl-4-[2-(1H-indol-2-yl)-1-oxo-1,3-dithian-2-yl]-1-methyl-3-piperidinol IUPAC Name: (3S,4R)-3-ethyl-4-[2-(1H-indol-2-yl)-1-oxo-1,3-dithian-2-yl]-1-methylpiperidin-3-ol Traditional Name: (3S,4R)-3-ethyl-4-[2-(1H-indol-2-yl)-1-keto-1,3-dithian-2-yl]-1-methyl-piperidin-3-ol Formula: C20H28N2O2S2 MolecularWeight: 392.57852

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CN(CCC1C2(SCCCS2=O)C3=CC4=CC=CC=C4N3)C)O

Isomeric SMILES

CC[C@]1(CN(CC[C@H]1C2(SCCCS2=O)C3=CC4=CC=CC=C4N3)C)O

InChI

InChI=1S/C20H28N2O2S2/c1-3-19(23)14-22(2)10-9-17(19)20(25-11-6-12-26(20)24)18-13-15-7-4-5-8-16(15)21-18/h4-5,7-8,13,17,21,23H,3,6,9-12,14H2,1-2H3/t17-,19-,20?,26?/m1/s1