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

Systemtic Name: 2-[(4-methoxyphenyl)methyl-methyl-amino]-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-[(4-methoxyphenyl)methyl-methyl-amino]-1-[4-(p-tolylsulfonyl)piperazin-1-yl]ethanone CAS Name: 2-[(4-methoxyphenyl)methyl-methylamino]-1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-[(4-methoxyphenyl)methyl-methylamino]-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-[methyl(p-anisyl)amino]-1-(4-tosylpiperazino)ethanone Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN(C)CC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN(C)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H29N3O4S/c1-18-4-10-21(11-5-18)30(27,28)25-14-12-24(13-15-25)22(26)17-23(2)16-19-6-8-20(29-3)9-7-19/h4-11H,12-17H2,1-3H3