N-[1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]-3-methyl-2-[(phenylmethyl)carbamoylamino]pentanamide

Systemtic Name: N-[1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]-3-methyl-2-[(phenylmethyl)carbamoylamino]pentanamide Openeye Name: 2-(benzylcarbamoylamino)-N-[1-(hydroxymethyl)-2-(1H-indol-3-yl)ethyl]-3-methyl-pentanamide CAS Name: N-[1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-3-methyl-2-[[oxo-[(phenylmethyl)amino]methyl]amino]pentanamide IUPAC Name: 2-(benzylcarbamoylamino)-N-[1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-3-methylpentanamide Traditional Name: 2-(benzylcarbamoylamino)-N-[2-hydroxy-1-(1H-indol-3-ylmethyl)ethyl]-3-methyl-valeramide Formula: C25H32N4O3 MolecularWeight: 436.54658

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(CC1=CNC2=CC=CC=C21)CO)NC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCC(C)C(C(=O)NC(CC1=CNC2=CC=CC=C21)CO)NC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C25H32N4O3/c1-3-17(2)23(29-25(32)27-14-18-9-5-4-6-10-18)24(31)28-20(16-30)13-19-15-26-22-12-8-7-11-21(19)22/h4-12,15,17,20,23,26,30H,3,13-14,16H2,1-2H3,(H,28,31)(H2,27,29,32)