N-[(2S)-3-[(5-tert-butyl-1,2-oxazol-3-yl)methylsulfonyl-(cyclopentylmethyl)amino]-2-oxidanyl-propyl]-N-phenethyl-benzamide

Systemtic Name: N-[(2S)-3-[(5-tert-butyl-1,2-oxazol-3-yl)methylsulfonyl-(cyclopentylmethyl)amino]-2-oxidanyl-propyl]-N-phenethyl-benzamide Openeye Name: N-[(2S)-3-[(5-tert-butylisoxazol-3-yl)methylsulfonyl-(cyclopentylmethyl)amino]-2-hydroxy-propyl]-N-phenethyl-benzamide CAS Name: N-[(2S)-3-[(5-tert-butyl-3-isoxazolyl)methylsulfonyl-(cyclopentylmethyl)amino]-2-hydroxypropyl]-N-phenethylbenzamide IUPAC Name: N-[(2S)-3-[(5-tert-butyl-1,2-oxazol-3-yl)methylsulfonyl-(cyclopentylmethyl)amino]-2-hydroxypropyl]-N-phenethylbenzamide Traditional Name: N-[(2S)-3-[(5-tert-butylisoxazol-3-yl)methylsulfonyl-(cyclopentylmethyl)amino]-2-hydroxy-propyl]-N-phenethyl-benzamide Formula: C32H43N3O5S MolecularWeight: 581.76592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NO1)CS(=O)(=O)N(CC2CCCC2)CC(CN(CCC3=CC=CC=C3)C(=O)C4=CC=CC=C4)O

Isomeric SMILES

CC(C)(C)C1=CC(=NO1)CS(=O)(=O)N(CC2CCCC2)C[C@H](CN(CCC3=CC=CC=C3)C(=O)C4=CC=CC=C4)O

InChI

InChI=1S/C32H43N3O5S/c1-32(2,3)30-20-28(33-40-30)24-41(38,39)35(21-26-14-10-11-15-26)23-29(36)22-34(19-18-25-12-6-4-7-13-25)31(37)27-16-8-5-9-17-27/h4-9,12-13,16-17,20,26,29,36H,10-11,14-15,18-19,21-24H2,1-3H3/t29-/m0/s1