3-(1H-indol-3-yl)-1-[(3S)-3-thiomorpholin-4-ylcarbonylpiperidin-1-yl]propan-1-one

Systemtic Name: 3-(1H-indol-3-yl)-1-[(3S)-3-thiomorpholin-4-ylcarbonylpiperidin-1-yl]propan-1-one Openeye Name: 3-(1H-indol-3-yl)-1-[(3S)-3-(thiomorpholine-4-carbonyl)-1-piperidyl]propan-1-one CAS Name: 3-(1H-indol-3-yl)-1-[(3S)-3-[oxo(thiomorpholin-4-yl)methyl]-1-piperidinyl]-1-propanone IUPAC Name: 3-(1H-indol-3-yl)-1-[(3S)-3-(thiomorpholine-4-carbonyl)piperidin-1-yl]propan-1-one Traditional Name: 3-(1H-indol-3-yl)-1-[(3S)-3-(thiomorpholine-4-carbonyl)piperidino]propan-1-one Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CCC2=CNC3=CC=CC=C32)C(=O)N4CCSCC4

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)CCC2=CNC3=CC=CC=C32)C(=O)N4CCSCC4

InChI

InChI=1S/C21H27N3O2S/c25-20(8-7-16-14-22-19-6-2-1-5-18(16)19)24-9-3-4-17(15-24)21(26)23-10-12-27-13-11-23/h1-2,5-6,14,17,22H,3-4,7-13,15H2/t17-/m0/s1