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

Systemtic Name: 1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(4-methoxyphenyl)sulfanyl-propan-1-one Openeye Name: 1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(4-methoxyphenyl)sulfanyl-propan-1-one CAS Name: 1-[4-(2,3-dimethylphenyl)-1-piperazinyl]-2-[(4-methoxyphenyl)thio]-1-propanone IUPAC Name: 1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(4-methoxyphenyl)sulfanylpropan-1-one Traditional Name: 1-[4-(2,3-dimethylphenyl)piperazino]-2-[(4-methoxyphenyl)thio]propan-1-one Formula: C22H28N2O2S MolecularWeight: 384.53492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C(C)SC3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C(C)SC3=CC=C(C=C3)OC)C

InChI

InChI=1S/C22H28N2O2S/c1-16-6-5-7-21(17(16)2)23-12-14-24(15-13-23)22(25)18(3)27-20-10-8-19(26-4)9-11-20/h5-11,18H,12-15H2,1-4H3