1-(4-methylsulfonylpiperazin-1-yl)-2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]ethanone

Systemtic Name: 1-(4-methylsulfonylpiperazin-1-yl)-2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]ethanone Openeye Name: 1-(4-methylsulfonylpiperazin-1-yl)-2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]ethanone CAS Name: 1-(4-methylsulfonyl-1-piperazinyl)-2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]ethanone IUPAC Name: 1-(4-methylsulfonylpiperazin-1-yl)-2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]ethanone Traditional Name: 1-(4-mesylpiperazino)-2-[methyl-(2,3,4-trimethoxybenzyl)amino]ethanone Formula: C18H29N3O6S MolecularWeight: 415.50436

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H29N3O6S/c1-19(12-14-6-7-15(25-2)18(27-4)17(14)26-3)13-16(22)20-8-10-21(11-9-20)28(5,23)24/h6-7H,8-13H2,1-5H3