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

Systemtic Name: 1-[4-[4-[1-(1,3-benzoxazol-2-yl)piperidin-4-yl]carbonylpiperazin-1-yl]sulfonylphenyl]ethanone Openeye Name: 1-[4-[4-[1-(1,3-benzoxazol-2-yl)piperidine-4-carbonyl]piperazin-1-yl]sulfonylphenyl]ethanone CAS Name: 1-[4-[[4-[[1-(1,3-benzoxazol-2-yl)-4-piperidinyl]-oxomethyl]-1-piperazinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[4-[4-[1-(1,3-benzoxazol-2-yl)piperidine-4-carbonyl]piperazin-1-yl]sulfonylphenyl]ethanone Traditional Name: 1-[4-[4-[1-(1,3-benzoxazol-2-yl)isonipecotoyl]piperazino]sulfonylphenyl]ethanone Formula: C25H28N4O5S MolecularWeight: 496.57862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3CCN(CC3)C4=NC5=CC=CC=C5O4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3CCN(CC3)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C25H28N4O5S/c1-18(30)19-6-8-21(9-7-19)35(32,33)29-16-14-27(15-17-29)24(31)20-10-12-28(13-11-20)25-26-22-4-2-3-5-23(22)34-25/h2-9,20H,10-17H2,1H3