N-[(2S)-3-(1H-indol-3-yl)-1-(methylamino)-1-oxidanylidene-propan-2-yl]-4-methyl-pentanamide

Systemtic Name: N-[(2S)-3-(1H-indol-3-yl)-1-(methylamino)-1-oxidanylidene-propan-2-yl]-4-methyl-pentanamide Openeye Name: N-[(1S)-1-(1H-indol-3-ylmethyl)-2-(methylamino)-2-oxo-ethyl]-4-methyl-pentanamide CAS Name: N-[(2S)-3-(1H-indol-3-yl)-1-(methylamino)-1-oxopropan-2-yl]-4-methylpentanamide IUPAC Name: N-[(2S)-3-(1H-indol-3-yl)-1-(methylamino)-1-oxopropan-2-yl]-4-methylpentanamide Traditional Name: N-[(1S)-1-(1H-indol-3-ylmethyl)-2-keto-2-(methylamino)ethyl]-4-methyl-valeramide Formula: C18H25N3O2 MolecularWeight: 315.41

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NC

Isomeric SMILES

CC(C)CCC(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)NC

InChI

InChI=1S/C18H25N3O2/c1-12(2)8-9-17(22)21-16(18(23)19-3)10-13-11-20-15-7-5-4-6-14(13)15/h4-7,11-12,16,20H,8-10H2,1-3H3,(H,19,23)(H,21,22)/t16-/m0/s1