2-azanyl-4-methylsulfanyl-2-(2-phenoxyphenyl)carbonyl-5-pyridin-3-yloxy-pentanoic acid

Systemtic Name: 2-azanyl-4-methylsulfanyl-2-(2-phenoxyphenyl)carbonyl-5-pyridin-3-yloxy-pentanoic acid Openeye Name: 2-amino-4-methylsulfanyl-2-(2-phenoxybenzoyl)-5-(3-pyridyloxy)pentanoic acid CAS Name: 2-amino-4-(methylthio)-2-[oxo-(2-phenoxyphenyl)methyl]-5-(3-pyridinyloxy)pentanoic acid IUPAC Name: 2-amino-4-methylsulfanyl-2-(2-phenoxybenzoyl)-5-pyridin-3-yloxypentanoic acid Traditional Name: 2-amino-4-(methylthio)-2-(2-phenoxybenzoyl)-5-(3-pyridyloxy)valeric acid Formula: C24H24N2O5S MolecularWeight: 452.52276

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Descriptors Computed from Structure

Canonical SMILES:

CSC(CC(C(=O)C1=CC=CC=C1OC2=CC=CC=C2)(C(=O)O)N)COC3=CN=CC=C3

Isomeric SMILES

CSC(CC(C(=O)C1=CC=CC=C1OC2=CC=CC=C2)(C(=O)O)N)COC3=CN=CC=C3

InChI

InChI=1S/C24H24N2O5S/c1-32-19(16-30-18-10-7-13-26-15-18)14-24(25,23(28)29)22(27)20-11-5-6-12-21(20)31-17-8-3-2-4-9-17/h2-13,15,19H,14,16,25H2,1H3,(H,28,29)