2-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-1-[4-(thiophen-2-ylmethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-1-[4-(thiophen-2-ylmethyl)piperazin-1-yl]ethanone Openeye Name: 2-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-1-[4-(2-thienylmethyl)piperazin-1-yl]ethanone CAS Name: 2-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-1-[4-(thiophen-2-ylmethyl)-1-piperazinyl]ethanone IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-1-[4-(thiophen-2-ylmethyl)piperazin-1-yl]ethanone Traditional Name: 2-[homoveratryl(methyl)amino]-1-[4-(2-thenyl)piperazino]ethanone Formula: C22H31N3O3S MolecularWeight: 417.56484

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)CC(=O)N2CCN(CC2)CC3=CC=CS3

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)CC(=O)N2CCN(CC2)CC3=CC=CS3

InChI

InChI=1S/C22H31N3O3S/c1-23(9-8-18-6-7-20(27-2)21(15-18)28-3)17-22(26)25-12-10-24(11-13-25)16-19-5-4-14-29-19/h4-7,14-15H,8-13,16-17H2,1-3H3