2-[[(2S)-3-methyl-2-[(4-methylphenyl)carbonylamino]butanoyl]amino]-N-(1-phenylethyl)benzamide

Systemtic Name: 2-[[(2S)-3-methyl-2-[(4-methylphenyl)carbonylamino]butanoyl]amino]-N-(1-phenylethyl)benzamide Openeye Name: 2-[[(2S)-3-methyl-2-[(4-methylbenzoyl)amino]butanoyl]amino]-N-(1-phenylethyl)benzamide CAS Name: 2-[[(2S)-3-methyl-2-[[(4-methylphenyl)-oxomethyl]amino]-1-oxobutyl]amino]-N-(1-phenylethyl)benzamide IUPAC Name: 2-[[(2S)-3-methyl-2-[(4-methylbenzoyl)amino]butanoyl]amino]-N-(1-phenylethyl)benzamide Traditional Name: 2-[[(2S)-3-methyl-2-(p-toluoylamino)butanoyl]amino]-N-(1-phenylethyl)benzamide Formula: C28H31N3O3 MolecularWeight: 457.56404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(C(C)C)C(=O)NC2=CC=CC=C2C(=O)NC(C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N[C@@H](C(C)C)C(=O)NC2=CC=CC=C2C(=O)NC(C)C3=CC=CC=C3

InChI

InChI=1S/C28H31N3O3/c1-18(2)25(31-26(32)22-16-14-19(3)15-17-22)28(34)30-24-13-9-8-12-23(24)27(33)29-20(4)21-10-6-5-7-11-21/h5-18,20,25H,1-4H3,(H,29,33)(H,30,34)(H,31,32)/t20?,25-/m0/s1