(2S)-2-acetamido-N-[(1,3-diphenylpyrazol-4-yl)methyl]-3-(1H-indol-3-yl)propanamide

Systemtic Name: (2S)-2-acetamido-N-[(1,3-diphenylpyrazol-4-yl)methyl]-3-(1H-indol-3-yl)propanamide Openeye Name: (2S)-2-acetamido-N-[(1,3-diphenylpyrazol-4-yl)methyl]-3-(1H-indol-3-yl)propanamide CAS Name: (2S)-2-acetamido-N-[(1,3-diphenyl-4-pyrazolyl)methyl]-3-(1H-indol-3-yl)propanamide IUPAC Name: (2S)-2-acetamido-N-[(1,3-diphenylpyrazol-4-yl)methyl]-3-(1H-indol-3-yl)propanamide Traditional Name: (2S)-2-acetamido-N-[(1,3-diphenylpyrazol-4-yl)methyl]-3-(1H-indol-3-yl)propionamide Formula: C29H27N5O2 MolecularWeight: 477.55698

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NCC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)NCC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H27N5O2/c1-20(35)32-27(16-22-17-30-26-15-9-8-14-25(22)26)29(36)31-18-23-19-34(24-12-6-3-7-13-24)33-28(23)21-10-4-2-5-11-21/h2-15,17,19,27,30H,16,18H2,1H3,(H,31,36)(H,32,35)/t27-/m0/s1