2-[methylsulfonyl(phenyl)amino]-N-[2-(phenylmethylsulfanyl)ethyl]butanamide

Systemtic Name: 2-[methylsulfonyl(phenyl)amino]-N-[2-(phenylmethylsulfanyl)ethyl]butanamide Openeye Name: N-(2-benzylsulfanylethyl)-2-(N-methylsulfonylanilino)butanamide CAS Name: 2-(N-methylsulfonylanilino)-N-[2-(phenylmethylthio)ethyl]butanamide IUPAC Name: N-(2-benzylsulfanylethyl)-2-(N-methylsulfonylanilino)butanamide Traditional Name: N-[2-(benzylthio)ethyl]-2-(N-mesylanilino)butyramide Formula: C20H26N2O3S2 MolecularWeight: 406.56204

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCCSCC1=CC=CC=C1)N(C2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NCCSCC1=CC=CC=C1)N(C2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C20H26N2O3S2/c1-3-19(22(27(2,24)25)18-12-8-5-9-13-18)20(23)21-14-15-26-16-17-10-6-4-7-11-17/h4-13,19H,3,14-16H2,1-2H3,(H,21,23)