2-[[(4-fluorophenyl)-phenyl-methyl]-methyl-amino]-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-[[(4-fluorophenyl)-phenyl-methyl]-methyl-amino]-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-[[(4-fluorophenyl)-phenyl-methyl]-methyl-amino]-1-[4-(p-tolylsulfonyl)piperazin-1-yl]ethanone CAS Name: 2-[[(4-fluorophenyl)-phenylmethyl]-methylamino]-1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-[[(4-fluorophenyl)-phenylmethyl]-methylamino]-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-[[(4-fluorophenyl)-phenyl-methyl]-methyl-amino]-1-(4-tosylpiperazino)ethanone Formula: C27H30FN3O3S MolecularWeight: 495.608803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN(C)C(C3=CC=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN(C)C(C3=CC=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C27H30FN3O3S/c1-21-8-14-25(15-9-21)35(33,34)31-18-16-30(17-19-31)26(32)20-29(2)27(22-6-4-3-5-7-22)23-10-12-24(28)13-11-23/h3-15,27H,16-20H2,1-2H3