1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-[(phenylmethyl)-propan-2-yl-amino]ethanone

Systemtic Name: 1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-[(phenylmethyl)-propan-2-yl-amino]ethanone Openeye Name: 2-[benzyl(isopropyl)amino]-1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 1-[4-(3-fluorophenyl)sulfonyl-1-piperazinyl]-2-[(phenylmethyl)-propan-2-ylamino]ethanone IUPAC Name: 2-[benzyl(propan-2-yl)amino]-1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-[benzyl(isopropyl)amino]-1-[4-(3-fluorophenyl)sulfonylpiperazino]ethanone Formula: C22H28FN3O3S MolecularWeight: 433.539423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F

Isomeric SMILES

CC(C)N(CC1=CC=CC=C1)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F

InChI

InChI=1S/C22H28FN3O3S/c1-18(2)25(16-19-7-4-3-5-8-19)17-22(27)24-11-13-26(14-12-24)30(28,29)21-10-6-9-20(23)15-21/h3-10,15,18H,11-14,16-17H2,1-2H3