5-ethylsulfonyl-2-[3-(3-methylphenoxy)propylsulfanyl]-1,3-benzoxazole

Systemtic Name: 5-ethylsulfonyl-2-[3-(3-methylphenoxy)propylsulfanyl]-1,3-benzoxazole Openeye Name: 5-ethylsulfonyl-2-[3-(3-methylphenoxy)propylsulfanyl]-1,3-benzoxazole CAS Name: 5-ethylsulfonyl-2-[3-(3-methylphenoxy)propylthio]-1,3-benzoxazole IUPAC Name: 5-ethylsulfonyl-2-[3-(3-methylphenoxy)propylsulfanyl]-1,3-benzoxazole Traditional Name: 5-esyl-2-[3-(3-methylphenoxy)propylthio]-1,3-benzoxazole Formula: C19H21NO4S2 MolecularWeight: 391.50434

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCCCOC3=CC=CC(=C3)C

Isomeric SMILES

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCCCOC3=CC=CC(=C3)C

InChI

InChI=1S/C19H21NO4S2/c1-3-26(21,22)16-8-9-18-17(13-16)20-19(24-18)25-11-5-10-23-15-7-4-6-14(2)12-15/h4,6-9,12-13H,3,5,10-11H2,1-2H3