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

Systemtic Name: (3S,4R)-3-ethyl-4-[2-(1H-indol-2-yl)-1,3-dithian-2-yl]-1-methyl-piperidin-2-one Openeye Name: (3S,4R)-3-ethyl-4-[2-(1H-indol-2-yl)-1,3-dithian-2-yl]-1-methyl-piperidin-2-one CAS Name: (3S,4R)-3-ethyl-4-[2-(1H-indol-2-yl)-1,3-dithian-2-yl]-1-methyl-2-piperidinone IUPAC Name: (3S,4R)-3-ethyl-4-[2-(1H-indol-2-yl)-1,3-dithian-2-yl]-1-methylpiperidin-2-one Traditional Name: (3S,4R)-3-ethyl-4-[2-(1H-indol-2-yl)-1,3-dithian-2-yl]-1-methyl-2-piperidone Formula: C20H26N2OS2 MolecularWeight: 374.56324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C(CCN(C1=O)C)C2(SCCCS2)C3=CC4=CC=CC=C4N3

Isomeric SMILES

CC[C@H]1[C@@H](CCN(C1=O)C)C2(SCCCS2)C3=CC4=CC=CC=C4N3

InChI

InChI=1S/C20H26N2OS2/c1-3-15-16(9-10-22(2)19(15)23)20(24-11-6-12-25-20)18-13-14-7-4-5-8-17(14)21-18/h4-5,7-8,13,15-16,21H,3,6,9-12H2,1-2H3/t15-,16+/m0/s1