1-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-(4-piperidin-1-ylsulfonylphenyl)ethanone

Systemtic Name: 1-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-(4-piperidin-1-ylsulfonylphenyl)ethanone Openeye Name: 1-[4-(1,3-benzoxazol-2-yl)-1-piperidyl]-2-[4-(1-piperidylsulfonyl)phenyl]ethanone CAS Name: 1-[4-(1,3-benzoxazol-2-yl)-1-piperidinyl]-2-[4-(1-piperidinylsulfonyl)phenyl]ethanone IUPAC Name: 1-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-(4-piperidin-1-ylsulfonylphenyl)ethanone Traditional Name: 1-[4-(1,3-benzoxazol-2-yl)piperidino]-2-(4-piperidinosulfonylphenyl)ethanone Formula: C25H29N3O4S MolecularWeight: 467.58046

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CC(=O)N3CCC(CC3)C4=NC5=CC=CC=C5O4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CC(=O)N3CCC(CC3)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C25H29N3O4S/c29-24(18-19-8-10-21(11-9-19)33(30,31)28-14-4-1-5-15-28)27-16-12-20(13-17-27)25-26-22-6-2-3-7-23(22)32-25/h2-3,6-11,20H,1,4-5,12-18H2