(2S)-2-azanyl-N-[2-(4-butanoylphenyl)ethyl]-2-cyclohexylcarbonyl-5-phenyl-pentanamide

Systemtic Name: (2S)-2-azanyl-N-[2-(4-butanoylphenyl)ethyl]-2-cyclohexylcarbonyl-5-phenyl-pentanamide Openeye Name: (2S)-2-amino-N-[2-(4-butanoylphenyl)ethyl]-2-(cyclohexanecarbonyl)-5-phenyl-pentanamide CAS Name: (2S)-2-amino-2-[cyclohexyl(oxo)methyl]-N-[2-[4-(1-oxobutyl)phenyl]ethyl]-5-phenylpentanamide IUPAC Name: (2S)-2-amino-N-[2-(4-butanoylphenyl)ethyl]-2-(cyclohexanecarbonyl)-5-phenylpentanamide Traditional Name: (2S)-2-amino-N-[2-(4-butyrylphenyl)ethyl]-2-(cyclohexanecarbonyl)-5-phenyl-valeramide Formula: C30H40N2O3 MolecularWeight: 476.6502

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC=C(C=C1)CCNC(=O)C(CCCC2=CC=CC=C2)(C(=O)C3CCCCC3)N

Isomeric SMILES

CCCC(=O)C1=CC=C(C=C1)CCNC(=O)[C@](CCCC2=CC=CC=C2)(C(=O)C3CCCCC3)N

InChI

InChI=1S/C30H40N2O3/c1-2-10-27(33)25-18-16-24(17-19-25)20-22-32-29(35)30(31,28(34)26-14-7-4-8-15-26)21-9-13-23-11-5-3-6-12-23/h3,5-6,11-12,16-19,26H,2,4,7-10,13-15,20-22,31H2,1H3,(H,32,35)/t30-/m0/s1