2-[(3,4,5-trimethoxyphenyl)methylsulfanyl]-1,3-benzoxazole

Systemtic Name: 2-[(3,4,5-trimethoxyphenyl)methylsulfanyl]-1,3-benzoxazole Openeye Name: 2-[(3,4,5-trimethoxyphenyl)methylsulfanyl]-1,3-benzoxazole CAS Name: 2-[(3,4,5-trimethoxyphenyl)methylthio]-1,3-benzoxazole IUPAC Name: 2-[(3,4,5-trimethoxyphenyl)methylsulfanyl]-1,3-benzoxazole Traditional Name: 2-[(3,4,5-trimethoxybenzyl)thio]-1,3-benzoxazole Formula: C17H17NO4S MolecularWeight: 331.38618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CSC2=NC3=CC=CC=C3O2

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CSC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C17H17NO4S/c1-19-14-8-11(9-15(20-2)16(14)21-3)10-23-17-18-12-6-4-5-7-13(12)22-17/h4-9H,10H2,1-3H3