(2S)-2-(1-benzofuran-2-ylmethylcarbamoylamino)-2-(1H-indol-3-ylmethyl)-3-methoxy-N-[(1S)-1-phenylethyl]propanamide

Systemtic Name: (2S)-2-(1-benzofuran-2-ylmethylcarbamoylamino)-2-(1H-indol-3-ylmethyl)-3-methoxy-N-[(1S)-1-phenylethyl]propanamide Openeye Name: (2S)-2-(benzofuran-2-ylmethylcarbamoylamino)-2-(1H-indol-3-ylmethyl)-3-methoxy-N-[(1S)-1-phenylethyl]propanamide CAS Name: (2S)-2-[[(2-benzofuranylmethylamino)-oxomethyl]amino]-2-(1H-indol-3-ylmethyl)-3-methoxy-N-[(1S)-1-phenylethyl]propanamide IUPAC Name: (2S)-2-(1-benzofuran-2-ylmethylcarbamoylamino)-2-(1H-indol-3-ylmethyl)-3-methoxy-N-[(1S)-1-phenylethyl]propanamide Traditional Name: (2S)-2-(benzofuran-2-ylmethylcarbamoylamino)-2-(1H-indol-3-ylmethyl)-3-methoxy-N-[(1S)-1-phenylethyl]propionamide Formula: C31H32N4O4 MolecularWeight: 524.61018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C(CC2=CNC3=CC=CC=C32)(COC)NC(=O)NCC4=CC5=CC=CC=C5O4

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC(=O)[C@](CC2=CNC3=CC=CC=C32)(COC)NC(=O)NCC4=CC5=CC=CC=C5O4

InChI

InChI=1S/C31H32N4O4/c1-21(22-10-4-3-5-11-22)34-29(36)31(20-38-2,17-24-18-32-27-14-8-7-13-26(24)27)35-30(37)33-19-25-16-23-12-6-9-15-28(23)39-25/h3-16,18,21,32H,17,19-20H2,1-2H3,(H,34,36)(H2,33,35,37)/t21-,31-/m0/s1