N-[4-(1,3-benzothiazol-2-ylsulfanyl)-3-chloranyl-phenyl]-2-phenoxy-ethanamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-ylsulfanyl)-3-chloranyl-phenyl]-2-phenoxy-ethanamide Openeye Name: N-[4-(1,3-benzothiazol-2-ylsulfanyl)-3-chloro-phenyl]-2-phenoxy-acetamide CAS Name: N-[4-(1,3-benzothiazol-2-ylthio)-3-chlorophenyl]-2-phenoxyacetamide IUPAC Name: N-[4-(1,3-benzothiazol-2-ylsulfanyl)-3-chlorophenyl]-2-phenoxyacetamide Traditional Name: N-[4-(1,3-benzothiazol-2-ylthio)-3-chloro-phenyl]-2-phenoxy-acetamide Formula: C21H15ClN2O2S2 MolecularWeight: 426.939

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC(=O)NC2=CC(=C(C=C2)SC3=NC4=CC=CC=C4S3)Cl

Isomeric SMILES

C1=CC=C(C=C1)OCC(=O)NC2=CC(=C(C=C2)SC3=NC4=CC=CC=C4S3)Cl

InChI

InChI=1S/C21H15ClN2O2S2/c22-16-12-14(23-20(25)13-26-15-6-2-1-3-7-15)10-11-18(16)27-21-24-17-8-4-5-9-19(17)28-21/h1-12H,13H2,(H,23,25)