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

Systemtic Name: N-[1-(1,3-benzoxazol-2-yl)-1-oxidanyl-4-phenyl-butan-2-yl]-3-[(3-methylpyridin-2-yl)methylsulfonyl]propanamide Openeye Name: N-[1-[1,3-benzoxazol-2-yl(hydroxy)methyl]-3-phenyl-propyl]-3-[(3-methyl-2-pyridyl)methylsulfonyl]propanamide CAS Name: N-[1-(1,3-benzoxazol-2-yl)-1-hydroxy-4-phenylbutan-2-yl]-3-[(3-methyl-2-pyridinyl)methylsulfonyl]propanamide IUPAC Name: N-[1-(1,3-benzoxazol-2-yl)-1-hydroxy-4-phenylbutan-2-yl]-3-[(3-methylpyridin-2-yl)methylsulfonyl]propanamide Traditional Name: N-[1-[1,3-benzoxazol-2-yl(hydroxy)methyl]-3-phenyl-propyl]-3-[(3-methyl-2-pyridyl)methylsulfonyl]propionamide Formula: C27H29N3O5S MolecularWeight: 507.60126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)CS(=O)(=O)CCC(=O)NC(CCC2=CC=CC=C2)C(C3=NC4=CC=CC=C4O3)O

Isomeric SMILES

CC1=C(N=CC=C1)CS(=O)(=O)CCC(=O)NC(CCC2=CC=CC=C2)C(C3=NC4=CC=CC=C4O3)O

InChI

InChI=1S/C27H29N3O5S/c1-19-8-7-16-28-23(19)18-36(33,34)17-15-25(31)29-22(14-13-20-9-3-2-4-10-20)26(32)27-30-21-11-5-6-12-24(21)35-27/h2-12,16,22,26,32H,13-15,17-18H2,1H3,(H,29,31)