(2S)-2-[[(2R)-2-(1H-indol-3-yl)-2-thiophen-2-yl-ethyl]amino]-1-piperidin-1-yl-propan-1-one

Systemtic Name: (2S)-2-[[(2R)-2-(1H-indol-3-yl)-2-thiophen-2-yl-ethyl]amino]-1-piperidin-1-yl-propan-1-one Openeye Name: (2S)-2-[[(2R)-2-(1H-indol-3-yl)-2-(2-thienyl)ethyl]amino]-1-(1-piperidyl)propan-1-one CAS Name: (2S)-2-[[(2R)-2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]amino]-1-(1-piperidinyl)-1-propanone IUPAC Name: (2S)-2-[[(2R)-2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]amino]-1-piperidin-1-ylpropan-1-one Traditional Name: (2S)-2-[[(2R)-2-(1H-indol-3-yl)-2-(2-thienyl)ethyl]amino]-1-piperidino-propan-1-one Formula: C22H27N3OS MolecularWeight: 381.53428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCC1)NCC(C2=CC=CS2)C3=CNC4=CC=CC=C43

Isomeric SMILES

C[C@@H](C(=O)N1CCCCC1)NC[C@H](C2=CC=CS2)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C22H27N3OS/c1-16(22(26)25-11-5-2-6-12-25)23-15-19(21-10-7-13-27-21)18-14-24-20-9-4-3-8-17(18)20/h3-4,7-10,13-14,16,19,23-24H,2,5-6,11-12,15H2,1H3/t16-,19-/m0/s1