1-methyl-N-[(2S)-1-oxidanylidene-1-(3-phenylpropylamino)propan-2-yl]-9H-pyrido[3,4-b]indole-3-carboxamide

Systemtic Name: 1-methyl-N-[(2S)-1-oxidanylidene-1-(3-phenylpropylamino)propan-2-yl]-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: 1-methyl-N-[(1S)-1-methyl-2-oxo-2-(3-phenylpropylamino)ethyl]-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: 1-methyl-N-[(2S)-1-oxo-1-(3-phenylpropylamino)propan-2-yl]-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: 1-methyl-N-[(2S)-1-oxo-1-(3-phenylpropylamino)propan-2-yl]-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: N-[(1S)-2-keto-1-methyl-2-(3-phenylpropylamino)ethyl]-1-methyl-9H-$b-carboline-3-carboxamide Formula: C25H26N4O2 MolecularWeight: 414.49954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=N1)C(=O)NC(C)C(=O)NCCCC3=CC=CC=C3)C4=CC=CC=C4N2

Isomeric SMILES

CC1=C2C(=CC(=N1)C(=O)N[C@@H](C)C(=O)NCCCC3=CC=CC=C3)C4=CC=CC=C4N2

InChI

InChI=1S/C25H26N4O2/c1-16-23-20(19-12-6-7-13-21(19)29-23)15-22(27-16)25(31)28-17(2)24(30)26-14-8-11-18-9-4-3-5-10-18/h3-7,9-10,12-13,15,17,29H,8,11,14H2,1-2H3,(H,26,30)(H,28,31)/t17-/m0/s1