N-[2-(1,3-benzothiazol-2-ylsulfanyl)ethyl]-2-[phenyl(phenylsulfonyl)amino]ethanamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-ylsulfanyl)ethyl]-2-[phenyl(phenylsulfonyl)amino]ethanamide Openeye Name: 2-[N-(benzenesulfonyl)anilino]-N-[2-(1,3-benzothiazol-2-ylsulfanyl)ethyl]acetamide CAS Name: 2-[N-(benzenesulfonyl)anilino]-N-[2-(1,3-benzothiazol-2-ylthio)ethyl]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)anilino]-N-[2-(1,3-benzothiazol-2-ylsulfanyl)ethyl]acetamide Traditional Name: N-[2-(1,3-benzothiazol-2-ylthio)ethyl]-2-(N-besylanilino)acetamide Formula: C23H21N3O3S3 MolecularWeight: 483.62614

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CC(=O)NCCSC2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)N(CC(=O)NCCSC2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H21N3O3S3/c27-22(24-15-16-30-23-25-20-13-7-8-14-21(20)31-23)17-26(18-9-3-1-4-10-18)32(28,29)19-11-5-2-6-12-19/h1-14H,15-17H2,(H,24,27)