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

Systemtic Name: 3-ethyl-3-[[2-(1H-indol-2-yl)-1,3-dithian-2-yl]methyl]-1-methyl-piperidin-2-one Openeye Name: 3-ethyl-3-[[2-(1H-indol-2-yl)-1,3-dithian-2-yl]methyl]-1-methyl-piperidin-2-one CAS Name: 3-ethyl-3-[[2-(1H-indol-2-yl)-1,3-dithian-2-yl]methyl]-1-methyl-2-piperidinone IUPAC Name: 3-ethyl-3-[[2-(1H-indol-2-yl)-1,3-dithian-2-yl]methyl]-1-methylpiperidin-2-one Traditional Name: 3-ethyl-3-[[2-(1H-indol-2-yl)-1,3-dithian-2-yl]methyl]-1-methyl-2-piperidone Formula: C21H28N2OS2 MolecularWeight: 388.58982

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCCN(C1=O)C)CC2(SCCCS2)C3=CC4=CC=CC=C4N3

Isomeric SMILES

CCC1(CCCN(C1=O)C)CC2(SCCCS2)C3=CC4=CC=CC=C4N3

InChI

InChI=1S/C21H28N2OS2/c1-3-20(10-6-11-23(2)19(20)24)15-21(25-12-7-13-26-21)18-14-16-8-4-5-9-17(16)22-18/h4-5,8-9,14,22H,3,6-7,10-13,15H2,1-2H3