4-[4-(5-ethylsulfonyl-1,3-benzoxazol-2-yl)piperidin-1-yl]sulfonylaniline

Systemtic Name: 4-[4-(5-ethylsulfonyl-1,3-benzoxazol-2-yl)piperidin-1-yl]sulfonylaniline Openeye Name: 4-[[4-(5-ethylsulfonyl-1,3-benzoxazol-2-yl)-1-piperidyl]sulfonyl]aniline CAS Name: 4-[[4-(5-ethylsulfonyl-1,3-benzoxazol-2-yl)-1-piperidinyl]sulfonyl]aniline IUPAC Name: 4-[4-(5-ethylsulfonyl-1,3-benzoxazol-2-yl)piperidin-1-yl]sulfonylaniline Traditional Name: [4-[4-(5-esyl-1,3-benzoxazol-2-yl)piperidino]sulfonylphenyl]amine Formula: C20H23N3O5S2 MolecularWeight: 449.54372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=N2)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)N

Isomeric SMILES

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=N2)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)N

InChI

InChI=1S/C20H23N3O5S2/c1-2-29(24,25)17-7-8-19-18(13-17)22-20(28-19)14-9-11-23(12-10-14)30(26,27)16-5-3-15(21)4-6-16/h3-8,13-14H,2,9-12,21H2,1H3