(2S)-6-azanyl-N-(4-methylphenyl)-2-[(4-phenylmethoxyphenyl)carbamoylamino]hexanamide

Systemtic Name: (2S)-6-azanyl-N-(4-methylphenyl)-2-[(4-phenylmethoxyphenyl)carbamoylamino]hexanamide Openeye Name: (2S)-6-amino-2-[(4-benzyloxyphenyl)carbamoylamino]-N-(p-tolyl)hexanamide CAS Name: (2S)-6-amino-N-(4-methylphenyl)-2-[[oxo-(4-phenylmethoxyanilino)methyl]amino]hexanamide IUPAC Name: (2S)-6-amino-N-(4-methylphenyl)-2-[(4-phenylmethoxyphenyl)carbamoylamino]hexanamide Traditional Name: (2S)-6-amino-2-[(4-benzoxyphenyl)carbamoylamino]-N-(p-tolyl)hexanamide Formula: C27H32N4O3 MolecularWeight: 460.56798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(CCCCN)NC(=O)NC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)[C@H](CCCCN)NC(=O)NC2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C27H32N4O3/c1-20-10-12-22(13-11-20)29-26(32)25(9-5-6-18-28)31-27(33)30-23-14-16-24(17-15-23)34-19-21-7-3-2-4-8-21/h2-4,7-8,10-17,25H,5-6,9,18-19,28H2,1H3,(H,29,32)(H2,30,31,33)/t25-/m0/s1