N-[2-[(4-methylphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]-2-phenoxy-ethanamide

Systemtic Name: N-[2-[(4-methylphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]-2-phenoxy-ethanamide Openeye Name: 2-phenoxy-N-[2-(p-tolylmethylsulfanyl)-1,3-benzothiazol-6-yl]acetamide CAS Name: N-[2-[(4-methylphenyl)methylthio]-1,3-benzothiazol-6-yl]-2-phenoxyacetamide IUPAC Name: N-[2-[(4-methylphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]-2-phenoxyacetamide Traditional Name: N-[2-[(4-methylbenzyl)thio]-1,3-benzothiazol-6-yl]-2-phenoxy-acetamide Formula: C23H20N2O2S2 MolecularWeight: 420.5471

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)COC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)COC4=CC=CC=C4

InChI

InChI=1S/C23H20N2O2S2/c1-16-7-9-17(10-8-16)15-28-23-25-20-12-11-18(13-21(20)29-23)24-22(26)14-27-19-5-3-2-4-6-19/h2-13H,14-15H2,1H3,(H,24,26)