1-[2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylsulfanyl]-5-methyl-thiophen-3-yl]ethanone

Systemtic Name: 1-[2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylsulfanyl]-5-methyl-thiophen-3-yl]ethanone Openeye Name: 1-[2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylsulfanyl]-5-methyl-3-thienyl]ethanone CAS Name: 1-[2-[3-[4-(2-methoxyphenyl)-1-piperazinyl]propylthio]-5-methyl-3-thiophenyl]ethanone IUPAC Name: 1-[2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylsulfanyl]-5-methylthiophen-3-yl]ethanone Traditional Name: 1-[2-[3-[4-(2-methoxyphenyl)piperazino]propylthio]-5-methyl-3-thienyl]ethanone Formula: C21H28N2O2S2 MolecularWeight: 404.58922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)SCCCN2CCN(CC2)C3=CC=CC=C3OC)C(=O)C

Isomeric SMILES

CC1=CC(=C(S1)SCCCN2CCN(CC2)C3=CC=CC=C3OC)C(=O)C

InChI

InChI=1S/C21H28N2O2S2/c1-16-15-18(17(2)24)21(27-16)26-14-6-9-22-10-12-23(13-11-22)19-7-4-5-8-20(19)25-3/h4-5,7-8,15H,6,9-14H2,1-3H3