(2S)-N-[(5-bromanyl-2-methoxy-phenyl)methyl]-2-[(4-chlorophenyl)carbonylamino]-N-methyl-pentanediamide

Systemtic Name: (2S)-N-[(5-bromanyl-2-methoxy-phenyl)methyl]-2-[(4-chlorophenyl)carbonylamino]-N-methyl-pentanediamide Openeye Name: (2S)-N-[(5-bromo-2-methoxy-phenyl)methyl]-2-[(4-chlorobenzoyl)amino]-N-methyl-pentanediamide CAS Name: (2S)-N-[(5-bromo-2-methoxyphenyl)methyl]-2-[[(4-chlorophenyl)-oxomethyl]amino]-N-methylpentanediamide IUPAC Name: (2S)-N-[(5-bromo-2-methoxyphenyl)methyl]-2-[(4-chlorobenzoyl)amino]-N-methylpentanediamide Traditional Name: (2S)-N-(5-bromo-2-methoxy-benzyl)-2-[(4-chlorobenzoyl)amino]-N-methyl-glutaramide Formula: C21H23BrClN3O4 MolecularWeight: 496.78202

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)Br)OC)C(=O)C(CCC(=O)N)NC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CN(CC1=C(C=CC(=C1)Br)OC)C(=O)[C@H](CCC(=O)N)NC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H23BrClN3O4/c1-26(12-14-11-15(22)5-9-18(14)30-2)21(29)17(8-10-19(24)27)25-20(28)13-3-6-16(23)7-4-13/h3-7,9,11,17H,8,10,12H2,1-2H3,(H2,24,27)(H,25,28)/t17-/m0/s1