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

Systemtic Name: 2-(3,4-dimethoxyphenyl)sulfanyl-1-[4-(4-methoxyphenyl)piperazin-1-yl]propan-1-one Openeye Name: 2-(3,4-dimethoxyphenyl)sulfanyl-1-[4-(4-methoxyphenyl)piperazin-1-yl]propan-1-one CAS Name: 2-[(3,4-dimethoxyphenyl)thio]-1-[4-(4-methoxyphenyl)-1-piperazinyl]-1-propanone IUPAC Name: 2-(3,4-dimethoxyphenyl)sulfanyl-1-[4-(4-methoxyphenyl)piperazin-1-yl]propan-1-one Traditional Name: 2-[(3,4-dimethoxyphenyl)thio]-1-[4-(4-methoxyphenyl)piperazino]propan-1-one Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=C(C=C2)OC)SC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C2=CC=C(C=C2)OC)SC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H28N2O4S/c1-16(29-19-9-10-20(27-3)21(15-19)28-4)22(25)24-13-11-23(12-14-24)17-5-7-18(26-2)8-6-17/h5-10,15-16H,11-14H2,1-4H3