4-methoxy-N-(4-methyl-1-sulfanyl-pentan-2-yl)-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 4-methoxy-N-(4-methyl-1-sulfanyl-pentan-2-yl)-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-4-methoxy-N-[3-methyl-1-(sulfanylmethyl)butyl]benzenesulfonamide CAS Name: N-(1-mercapto-4-methylpentan-2-yl)-4-methoxy-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-4-methoxy-N-(4-methyl-1-sulfanylpentan-2-yl)benzenesulfonamide Traditional Name: N-benzyl-N-[1-(mercaptomethyl)-3-methyl-butyl]-4-methoxy-benzenesulfonamide Formula: C20H27NO3S2 MolecularWeight: 393.56328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CS)N(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)CC(CS)N(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C20H27NO3S2/c1-16(2)13-18(15-25)21(14-17-7-5-4-6-8-17)26(22,23)20-11-9-19(24-3)10-12-20/h4-12,16,18,25H,13-15H2,1-3H3