1-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-3-(4-methylphenyl)sulfanyl-propan-1-one

Systemtic Name: 1-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-3-(4-methylphenyl)sulfanyl-propan-1-one Openeye Name: 1-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-3-(p-tolylsulfanyl)propan-1-one CAS Name: 1-[4-[(2,5-dimethoxyphenyl)methyl]-1-piperazinyl]-3-[(4-methylphenyl)thio]-1-propanone IUPAC Name: 1-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-3-(4-methylphenyl)sulfanylpropan-1-one Traditional Name: 1-[4-(2,5-dimethoxybenzyl)piperazino]-3-(p-tolylthio)propan-1-one Formula: C23H30N2O3S MolecularWeight: 414.5609

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N2O3S/c1-18-4-7-21(8-5-18)29-15-10-23(26)25-13-11-24(12-14-25)17-19-16-20(27-2)6-9-22(19)28-3/h4-9,16H,10-15,17H2,1-3H3