N-[1-(1,3-benzoxazol-2-yl)-1-oxidanyl-4-phenyl-butan-2-yl]-3-(phenylmethyl)sulfonyl-propanamide

Systemtic Name: N-[1-(1,3-benzoxazol-2-yl)-1-oxidanyl-4-phenyl-butan-2-yl]-3-(phenylmethyl)sulfonyl-propanamide Openeye Name: N-[1-[1,3-benzoxazol-2-yl(hydroxy)methyl]-3-phenyl-propyl]-3-benzylsulfonyl-propanamide CAS Name: N-[1-(1,3-benzoxazol-2-yl)-1-hydroxy-4-phenylbutan-2-yl]-3-(phenylmethyl)sulfonylpropanamide IUPAC Name: N-[1-(1,3-benzoxazol-2-yl)-1-hydroxy-4-phenylbutan-2-yl]-3-benzylsulfonylpropanamide Traditional Name: N-[1-[1,3-benzoxazol-2-yl(hydroxy)methyl]-3-phenyl-propyl]-3-benzylsulfonyl-propionamide Formula: C27H28N2O5S MolecularWeight: 492.58662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(C(C2=NC3=CC=CC=C3O2)O)NC(=O)CCS(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCC(C(C2=NC3=CC=CC=C3O2)O)NC(=O)CCS(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C27H28N2O5S/c30-25(17-18-35(32,33)19-21-11-5-2-6-12-21)28-23(16-15-20-9-3-1-4-10-20)26(31)27-29-22-13-7-8-14-24(22)34-27/h1-14,23,26,31H,15-19H2,(H,28,30)