N-[2,6-di(propan-2-yl)phenyl]-9-[(5-oxidanyl-1,3-benzoxazol-2-yl)sulfanyl]nonanamide

Systemtic Name: N-[2,6-di(propan-2-yl)phenyl]-9-[(5-oxidanyl-1,3-benzoxazol-2-yl)sulfanyl]nonanamide Openeye Name: N-(2,6-diisopropylphenyl)-9-[(5-hydroxy-1,3-benzoxazol-2-yl)sulfanyl]nonanamide CAS Name: N-[2,6-di(propan-2-yl)phenyl]-9-[(5-hydroxy-1,3-benzoxazol-2-yl)thio]nonanamide IUPAC Name: N-[2,6-di(propan-2-yl)phenyl]-9-[(5-hydroxy-1,3-benzoxazol-2-yl)sulfanyl]nonanamide Traditional Name: N-(2,6-diisopropylphenyl)-9-[(5-hydroxy-1,3-benzoxazol-2-yl)thio]pelargonamide Formula: C28H38N2O3S MolecularWeight: 482.67792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)CCCCCCCCSC2=NC3=C(O2)C=CC(=C3)O

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)CCCCCCCCSC2=NC3=C(O2)C=CC(=C3)O

InChI

InChI=1S/C28H38N2O3S/c1-19(2)22-12-11-13-23(20(3)4)27(22)30-26(32)14-9-7-5-6-8-10-17-34-28-29-24-18-21(31)15-16-25(24)33-28/h11-13,15-16,18-20,31H,5-10,14,17H2,1-4H3,(H,30,32)