(2R)-N-[4-(tert-butylcarbamoylamino)-7-methyl-3-oxidanyl-1-phenyl-octan-2-yl]-2-methyl-3-phenethylsulfonyl-propanamide

Systemtic Name: (2R)-N-[4-(tert-butylcarbamoylamino)-7-methyl-3-oxidanyl-1-phenyl-octan-2-yl]-2-methyl-3-phenethylsulfonyl-propanamide Openeye Name: (2R)-N-[1-benzyl-3-(tert-butylcarbamoylamino)-2-hydroxy-6-methyl-heptyl]-2-methyl-3-phenethylsulfonyl-propanamide CAS Name: (2R)-N-[4-[[(tert-butylamino)-oxomethyl]amino]-3-hydroxy-7-methyl-1-phenyloctan-2-yl]-2-methyl-3-phenethylsulfonylpropanamide IUPAC Name: (2R)-N-[4-(tert-butylcarbamoylamino)-3-hydroxy-7-methyl-1-phenyloctan-2-yl]-2-methyl-3-phenethylsulfonylpropanamide Traditional Name: (2R)-N-[1-benzyl-3-(tert-butylcarbamoylamino)-2-hydroxy-6-methyl-heptyl]-2-methyl-3-phenethylsulfonyl-propionamide Formula: C32H49N3O5S MolecularWeight: 587.81356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C(C(CC1=CC=CC=C1)NC(=O)C(C)CS(=O)(=O)CCC2=CC=CC=C2)O)NC(=O)NC(C)(C)C

Isomeric SMILES

C[C@@H](CS(=O)(=O)CCC1=CC=CC=C1)C(=O)NC(CC2=CC=CC=C2)C(C(CCC(C)C)NC(=O)NC(C)(C)C)O

InChI

InChI=1S/C32H49N3O5S/c1-23(2)17-18-27(34-31(38)35-32(4,5)6)29(36)28(21-26-15-11-8-12-16-26)33-30(37)24(3)22-41(39,40)20-19-25-13-9-7-10-14-25/h7-16,23-24,27-29,36H,17-22H2,1-6H3,(H,33,37)(H2,34,35,38)/t24-,27?,28?,29?/m0/s1