N-[(2S,3R)-1-cyclohexyl-3-oxidanyl-4-propan-2-ylsulfonyl-butan-2-yl]-4-methyl-2-[[3-phenyl-2-(phenylmethyl)propanoyl]amino]pentanamide

Systemtic Name: N-[(2S,3R)-1-cyclohexyl-3-oxidanyl-4-propan-2-ylsulfonyl-butan-2-yl]-4-methyl-2-[[3-phenyl-2-(phenylmethyl)propanoyl]amino]pentanamide Openeye Name: 2-[(2-benzyl-3-phenyl-propanoyl)amino]-N-[(1S,2R)-1-(cyclohexylmethyl)-2-hydroxy-3-isopropylsulfonyl-propyl]-4-methyl-pentanamide CAS Name: N-[(2S,3R)-1-cyclohexyl-3-hydroxy-4-propan-2-ylsulfonylbutan-2-yl]-4-methyl-2-[[1-oxo-3-phenyl-2-(phenylmethyl)propyl]amino]pentanamide IUPAC Name: 2-[(2-benzyl-3-phenylpropanoyl)amino]-N-[(2S,3R)-1-cyclohexyl-3-hydroxy-4-propan-2-ylsulfonylbutan-2-yl]-4-methylpentanamide Traditional Name: 2-[(2-benzyl-3-phenyl-propanoyl)amino]-N-[(1S,2R)-1-(cyclohexylmethyl)-2-hydroxy-3-isopropylsulfonyl-propyl]-4-methyl-valeramide Formula: C35H52N2O5S MolecularWeight: 612.86278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1CCCCC1)C(CS(=O)(=O)C(C)C)O)NC(=O)C(CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)CC(C(=O)N[C@@H](CC1CCCCC1)[C@H](CS(=O)(=O)C(C)C)O)NC(=O)C(CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C35H52N2O5S/c1-25(2)20-32(37-34(39)30(21-27-14-8-5-9-15-27)22-28-16-10-6-11-17-28)35(40)36-31(23-29-18-12-7-13-19-29)33(38)24-43(41,42)26(3)4/h5-6,8-11,14-17,25-26,29-33,38H,7,12-13,18-24H2,1-4H3,(H,36,40)(H,37,39)/t31-,32?,33-/m0/s1