2-methyl-N-[(2S,3R)-5-[(4-methylphenyl)sulfonyl-propan-2-yl-amino]-3-oxidanyl-1-phenyl-pentan-2-yl]-3-oxidanyl-benzamide

Systemtic Name: 2-methyl-N-[(2S,3R)-5-[(4-methylphenyl)sulfonyl-propan-2-yl-amino]-3-oxidanyl-1-phenyl-pentan-2-yl]-3-oxidanyl-benzamide Openeye Name: N-[(1S,2R)-1-benzyl-2-hydroxy-4-[isopropyl(p-tolylsulfonyl)amino]butyl]-3-hydroxy-2-methyl-benzamide CAS Name: 3-hydroxy-N-[(2S,3R)-3-hydroxy-5-[(4-methylphenyl)sulfonyl-propan-2-ylamino]-1-phenylpentan-2-yl]-2-methylbenzamide IUPAC Name: 3-hydroxy-N-[(2S,3R)-3-hydroxy-5-[(4-methylphenyl)sulfonyl-propan-2-ylamino]-1-phenylpentan-2-yl]-2-methylbenzamide Traditional Name: N-[(1S,2R)-1-benzyl-2-hydroxy-4-[isopropyl(tosyl)amino]butyl]-3-hydroxy-2-methyl-benzamide Formula: C29H36N2O5S MolecularWeight: 524.67154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(C(CC2=CC=CC=C2)NC(=O)C3=C(C(=CC=C3)O)C)O)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC[C@H]([C@H](CC2=CC=CC=C2)NC(=O)C3=C(C(=CC=C3)O)C)O)C(C)C

InChI

InChI=1S/C29H36N2O5S/c1-20(2)31(37(35,36)24-15-13-21(3)14-16-24)18-17-28(33)26(19-23-9-6-5-7-10-23)30-29(34)25-11-8-12-27(32)22(25)4/h5-16,20,26,28,32-33H,17-19H2,1-4H3,(H,30,34)/t26-,28+/m0/s1