2-methyl-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-5-thiophen-2-yl-thieno[2,3-d]pyrimidine

Systemtic Name: 2-methyl-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-5-thiophen-2-yl-thieno[2,3-d]pyrimidine Openeye Name: 2-methyl-4-[4-(p-tolylsulfonyl)piperazin-1-yl]-5-(2-thienyl)thieno[2,3-d]pyrimidine CAS Name: 2-methyl-4-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-5-thiophen-2-ylthieno[2,3-d]pyrimidine IUPAC Name: 2-methyl-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-5-thiophen-2-ylthieno[2,3-d]pyrimidine Traditional Name: 2-methyl-5-(2-thienyl)-4-(4-tosylpiperazino)thieno[2,3-d]pyrimidine Formula: C22H22N4O2S3 MolecularWeight: 470.63068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C4C(=CSC4=NC(=N3)C)C5=CC=CS5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C4C(=CSC4=NC(=N3)C)C5=CC=CS5

InChI

InChI=1S/C22H22N4O2S3/c1-15-5-7-17(8-6-15)31(27,28)26-11-9-25(10-12-26)21-20-18(19-4-3-13-29-19)14-30-22(20)24-16(2)23-21/h3-8,13-14H,9-12H2,1-2H3