(3R)-3-azanyl-4-(2-fluorophenyl)-N-[(2R)-3-(1H-indol-3-yl)-1-(methylamino)-1-oxidanylidene-propan-2-yl]butanamide

Systemtic Name: (3R)-3-azanyl-4-(2-fluorophenyl)-N-[(2R)-3-(1H-indol-3-yl)-1-(methylamino)-1-oxidanylidene-propan-2-yl]butanamide Openeye Name: (3R)-3-amino-4-(2-fluorophenyl)-N-[(1R)-1-(1H-indol-3-ylmethyl)-2-(methylamino)-2-oxo-ethyl]butanamide CAS Name: (3R)-3-amino-4-(2-fluorophenyl)-N-[(2R)-3-(1H-indol-3-yl)-1-(methylamino)-1-oxopropan-2-yl]butanamide IUPAC Name: (3R)-3-amino-4-(2-fluorophenyl)-N-[(2R)-3-(1H-indol-3-yl)-1-(methylamino)-1-oxopropan-2-yl]butanamide Traditional Name: (3R)-3-amino-4-(2-fluorophenyl)-N-[(1R)-1-(1H-indol-3-ylmethyl)-2-keto-2-(methylamino)ethyl]butyramide Formula: C22H25FN4O2 MolecularWeight: 396.457903

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)CC(CC3=CC=CC=C3F)N

Isomeric SMILES

CNC(=O)[C@@H](CC1=CNC2=CC=CC=C21)NC(=O)C[C@@H](CC3=CC=CC=C3F)N

InChI

InChI=1S/C22H25FN4O2/c1-25-22(29)20(11-15-13-26-19-9-5-3-7-17(15)19)27-21(28)12-16(24)10-14-6-2-4-8-18(14)23/h2-9,13,16,20,26H,10-12,24H2,1H3,(H,25,29)(H,27,28)/t16-,20-/m1/s1