1-(4-methylphenyl)-2-[(5-morpholin-4-ylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]ethanone

Systemtic Name: 1-(4-methylphenyl)-2-[(5-morpholin-4-ylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]ethanone Openeye Name: 2-[(5-morpholinosulfonyl-1,3-benzoxazol-2-yl)sulfanyl]-1-(p-tolyl)ethanone CAS Name: 1-(4-methylphenyl)-2-[[5-(4-morpholinylsulfonyl)-1,3-benzoxazol-2-yl]thio]ethanone IUPAC Name: 1-(4-methylphenyl)-2-[(5-morpholin-4-ylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]ethanone Traditional Name: 2-[(5-morpholinosulfonyl-1,3-benzoxazol-2-yl)thio]-1-(p-tolyl)ethanone Formula: C20H20N2O5S2 MolecularWeight: 432.5132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CSC2=NC3=C(O2)C=CC(=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CSC2=NC3=C(O2)C=CC(=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C20H20N2O5S2/c1-14-2-4-15(5-3-14)18(23)13-28-20-21-17-12-16(6-7-19(17)27-20)29(24,25)22-8-10-26-11-9-22/h2-7,12H,8-11,13H2,1H3