N-[4-[1,3-benzodioxol-5-ylsulfonyl(methyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]-2-methyl-3-methylsulfonyl-propanamide

Systemtic Name: N-[4-[1,3-benzodioxol-5-ylsulfonyl(methyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]-2-methyl-3-methylsulfonyl-propanamide Openeye Name: N-[3-[1,3-benzodioxol-5-ylsulfonyl(methyl)amino]-1-benzyl-2-hydroxy-propyl]-2-methyl-3-methylsulfonyl-propanamide CAS Name: N-[4-[1,3-benzodioxol-5-ylsulfonyl(methyl)amino]-3-hydroxy-1-phenylbutan-2-yl]-2-methyl-3-methylsulfonylpropanamide IUPAC Name: N-[4-[1,3-benzodioxol-5-ylsulfonyl(methyl)amino]-3-hydroxy-1-phenylbutan-2-yl]-2-methyl-3-methylsulfonylpropanamide Traditional Name: N-[3-[1,3-benzodioxol-5-ylsulfonyl(methyl)amino]-1-benzyl-2-hydroxy-propyl]-3-mesyl-2-methyl-propionamide Formula: C23H30N2O8S2 MolecularWeight: 526.6229

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CS(=O)(=O)C)C(=O)NC(CC1=CC=CC=C1)C(CN(C)S(=O)(=O)C2=CC3=C(C=C2)OCO3)O

Isomeric SMILES

CC(CS(=O)(=O)C)C(=O)NC(CC1=CC=CC=C1)C(CN(C)S(=O)(=O)C2=CC3=C(C=C2)OCO3)O

InChI

InChI=1S/C23H30N2O8S2/c1-16(14-34(3,28)29)23(27)24-19(11-17-7-5-4-6-8-17)20(26)13-25(2)35(30,31)18-9-10-21-22(12-18)33-15-32-21/h4-10,12,16,19-20,26H,11,13-15H2,1-3H3,(H,24,27)