6-azanyl-N-(4-methylphenyl)-2-[2-[(3-phenoxyphenyl)amino]ethanoylamino]hexanamide

Systemtic Name: 6-azanyl-N-(4-methylphenyl)-2-[2-[(3-phenoxyphenyl)amino]ethanoylamino]hexanamide Openeye Name: 6-amino-2-[[2-(3-phenoxyanilino)acetyl]amino]-N-(p-tolyl)hexanamide CAS Name: 6-amino-N-(4-methylphenyl)-2-[[1-oxo-2-(3-phenoxyanilino)ethyl]amino]hexanamide IUPAC Name: 6-amino-N-(4-methylphenyl)-2-[[2-(3-phenoxyanilino)acetyl]amino]hexanamide Traditional Name: 6-amino-2-[[2-(3-phenoxyanilino)acetyl]amino]-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)CNC2=CC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C(CCCCN)NC(=O)CNC2=CC(=CC=C2)OC3=CC=CC=C3

InChI

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