2-methyl-3-methylsulfonyl-N-[3-oxidanyl-1-phenyl-4-[(phenylmethyl)amino]butan-2-yl]propanamide

Systemtic Name: 2-methyl-3-methylsulfonyl-N-[3-oxidanyl-1-phenyl-4-[(phenylmethyl)amino]butan-2-yl]propanamide Openeye Name: N-[1-benzyl-3-(benzylamino)-2-hydroxy-propyl]-2-methyl-3-methylsulfonyl-propanamide CAS Name: N-[3-hydroxy-1-phenyl-4-[(phenylmethyl)amino]butan-2-yl]-2-methyl-3-methylsulfonylpropanamide IUPAC Name: N-[4-(benzylamino)-3-hydroxy-1-phenylbutan-2-yl]-2-methyl-3-methylsulfonylpropanamide Traditional Name: N-[1-benzyl-3-(benzylamino)-2-hydroxy-propyl]-3-mesyl-2-methyl-propionamide Formula: C22H30N2O4S MolecularWeight: 418.5496

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS(=O)(=O)C)C(=O)NC(CC1=CC=CC=C1)C(CNCC2=CC=CC=C2)O

Isomeric SMILES

CC(CS(=O)(=O)C)C(=O)NC(CC1=CC=CC=C1)C(CNCC2=CC=CC=C2)O

InChI

InChI=1S/C22H30N2O4S/c1-17(16-29(2,27)28)22(26)24-20(13-18-9-5-3-6-10-18)21(25)15-23-14-19-11-7-4-8-12-19/h3-12,17,20-21,23,25H,13-16H2,1-2H3,(H,24,26)