N-(cyanomethyl)-3-(1H-indol-3-yl)-2-[[(1S)-1-phenylethyl]carbamoylamino]propanamide

Systemtic Name: N-(cyanomethyl)-3-(1H-indol-3-yl)-2-[[(1S)-1-phenylethyl]carbamoylamino]propanamide Openeye Name: N-(cyanomethyl)-3-(1H-indol-3-yl)-2-[[(1S)-1-phenylethyl]carbamoylamino]propanamide CAS Name: N-(cyanomethyl)-3-(1H-indol-3-yl)-2-[[oxo-[[(1S)-1-phenylethyl]amino]methyl]amino]propanamide IUPAC Name: N-(cyanomethyl)-3-(1H-indol-3-yl)-2-[[(1S)-1-phenylethyl]carbamoylamino]propanamide Traditional Name: N-(cyanomethyl)-3-(1H-indol-3-yl)-2-[[(1S)-1-phenylethyl]carbamoylamino]propionamide Formula: C22H23N5O2 MolecularWeight: 389.45032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)NCC#N

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)NCC#N

InChI

InChI=1S/C22H23N5O2/c1-15(16-7-3-2-4-8-16)26-22(29)27-20(21(28)24-12-11-23)13-17-14-25-19-10-6-5-9-18(17)19/h2-10,14-15,20,25H,12-13H2,1H3,(H,24,28)(H2,26,27,29)/t15-,20?/m0/s1