2-[4-(4-aminophenyl)-3-chloranyl-phenyl]-2-(1,3-oxazol-2-yl)-2-sulfanyl-ethanoic acid

Systemtic Name: 2-[4-(4-aminophenyl)-3-chloranyl-phenyl]-2-(1,3-oxazol-2-yl)-2-sulfanyl-ethanoic acid Openeye Name: 2-[4-(4-aminophenyl)-3-chloro-phenyl]-2-oxazol-2-yl-2-sulfanyl-acetic acid CAS Name: 2-[4-(4-aminophenyl)-3-chlorophenyl]-2-mercapto-2-(2-oxazolyl)acetic acid IUPAC Name: 2-[4-(4-aminophenyl)-3-chlorophenyl]-2-(1,3-oxazol-2-yl)-2-sulfanylacetic acid Traditional Name: 2-[4-(4-aminophenyl)-3-chloro-phenyl]-2-mercapto-2-oxazol-2-yl-acetic acid Formula: C17H13ClN2O3S MolecularWeight: 360.81472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(C=C(C=C2)C(C3=NC=CO3)(C(=O)O)S)Cl)N

Isomeric SMILES

C1=CC(=CC=C1C2=C(C=C(C=C2)C(C3=NC=CO3)(C(=O)O)S)Cl)N

InChI

InChI=1S/C17H13ClN2O3S/c18-14-9-11(17(24,16(21)22)15-20-7-8-23-15)3-6-13(14)10-1-4-12(19)5-2-10/h1-9,24H,19H2,(H,21,22)