(2S)-2-[2-[1-(1H-indol-3-ylmethyl)piperidin-4-yl]ethanoylamino]-3-phenyl-propanamide

Systemtic Name: (2S)-2-[2-[1-(1H-indol-3-ylmethyl)piperidin-4-yl]ethanoylamino]-3-phenyl-propanamide Openeye Name: (2S)-2-[[2-[1-(1H-indol-3-ylmethyl)-4-piperidyl]acetyl]amino]-3-phenyl-propanamide CAS Name: (2S)-2-[[2-[1-(1H-indol-3-ylmethyl)-4-piperidinyl]-1-oxoethyl]amino]-3-phenylpropanamide IUPAC Name: (2S)-2-[[2-[1-(1H-indol-3-ylmethyl)piperidin-4-yl]acetyl]amino]-3-phenylpropanamide Traditional Name: (2S)-2-[[2-[1-(1H-indol-3-ylmethyl)-4-piperidyl]acetyl]amino]-3-phenyl-propionamide Formula: C25H30N4O2 MolecularWeight: 418.5313

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC(=O)NC(CC2=CC=CC=C2)C(=O)N)CC3=CNC4=CC=CC=C43

Isomeric SMILES

C1CN(CCC1CC(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N)CC3=CNC4=CC=CC=C43

InChI

InChI=1S/C25H30N4O2/c26-25(31)23(14-18-6-2-1-3-7-18)28-24(30)15-19-10-12-29(13-11-19)17-20-16-27-22-9-5-4-8-21(20)22/h1-9,16,19,23,27H,10-15,17H2,(H2,26,31)(H,28,30)/t23-/m0/s1