2-azanyl-4-methylsulfanyl-2-(2-phenylphenyl)carbonyl-5-(2-pyridin-3-ylethanoylamino)pentanoic acid

Systemtic Name: 2-azanyl-4-methylsulfanyl-2-(2-phenylphenyl)carbonyl-5-(2-pyridin-3-ylethanoylamino)pentanoic acid Openeye Name: 2-amino-4-methylsulfanyl-2-(2-phenylbenzoyl)-5-[[2-(3-pyridyl)acetyl]amino]pentanoic acid CAS Name: 2-amino-4-(methylthio)-2-[oxo-(2-phenylphenyl)methyl]-5-[[1-oxo-2-(3-pyridinyl)ethyl]amino]pentanoic acid IUPAC Name: 2-amino-4-methylsulfanyl-2-(2-phenylbenzoyl)-5-[(2-pyridin-3-ylacetyl)amino]pentanoic acid Traditional Name: 2-amino-4-(methylthio)-2-(2-phenylbenzoyl)-5-[[2-(3-pyridyl)acetyl]amino]valeric acid Formula: C26H27N3O4S MolecularWeight: 477.57528

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Descriptors Computed from Structure

Canonical SMILES:

CSC(CC(C(=O)C1=CC=CC=C1C2=CC=CC=C2)(C(=O)O)N)CNC(=O)CC3=CN=CC=C3

Isomeric SMILES

CSC(CC(C(=O)C1=CC=CC=C1C2=CC=CC=C2)(C(=O)O)N)CNC(=O)CC3=CN=CC=C3

InChI

InChI=1S/C26H27N3O4S/c1-34-20(17-29-23(30)14-18-8-7-13-28-16-18)15-26(27,25(32)33)24(31)22-12-6-5-11-21(22)19-9-3-2-4-10-19/h2-13,16,20H,14-15,17,27H2,1H3,(H,29,30)(H,32,33)