1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanone

Systemtic Name: 1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanone Openeye Name: 1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanone CAS Name: 1-[4-(2,3-dimethylphenyl)-1-piperazinyl]-2-(4-thieno[2,3-d]pyrimidinylthio)ethanone IUPAC Name: 1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanone Traditional Name: 1-[4-(2,3-dimethylphenyl)piperazino]-2-(thieno[2,3-d]pyrimidin-4-ylthio)ethanone Formula: C20H22N4OS2 MolecularWeight: 398.54488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CSC3=NC=NC4=C3C=CS4)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CSC3=NC=NC4=C3C=CS4)C

InChI

InChI=1S/C20H22N4OS2/c1-14-4-3-5-17(15(14)2)23-7-9-24(10-8-23)18(25)12-27-20-16-6-11-26-19(16)21-13-22-20/h3-6,11,13H,7-10,12H2,1-2H3