2-[(2-chloranyl-1,3-thiazol-5-yl)methyl-(2,4-dichlorophenyl)carbonyl-amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[(2-chloranyl-1,3-thiazol-5-yl)methyl-(2,4-dichlorophenyl)carbonyl-amino]-3-phenyl-propanoic acid Openeye Name: 2-[(2-chlorothiazol-5-yl)methyl-(2,4-dichlorobenzoyl)amino]-3-phenyl-propanoic acid CAS Name: 2-[(2-chloro-5-thiazolyl)methyl-[(2,4-dichlorophenyl)-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[(2-chloro-1,3-thiazol-5-yl)methyl-(2,4-dichlorobenzoyl)amino]-3-phenylpropanoic acid Traditional Name: 2-[(2-chlorothiazol-5-yl)methyl-(2,4-dichlorobenzoyl)amino]-3-phenyl-propionic acid Formula: C20H15Cl3N2O3S MolecularWeight: 469.7687

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)N(CC2=CN=C(S2)Cl)C(=O)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)N(CC2=CN=C(S2)Cl)C(=O)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H15Cl3N2O3S/c21-13-6-7-15(16(22)9-13)18(26)25(11-14-10-24-20(23)29-14)17(19(27)28)8-12-4-2-1-3-5-12/h1-7,9-10,17H,8,11H2,(H,27,28)