5,6-dimethyl-2-(phenylsulfanylmethyl)-4-(4-pyrimidin-2-ylpiperazin-1-yl)thieno[2,3-d]pyrimidine

Systemtic Name: 5,6-dimethyl-2-(phenylsulfanylmethyl)-4-(4-pyrimidin-2-ylpiperazin-1-yl)thieno[2,3-d]pyrimidine Openeye Name: 5,6-dimethyl-2-(phenylsulfanylmethyl)-4-(4-pyrimidin-2-ylpiperazin-1-yl)thieno[2,3-d]pyrimidine CAS Name: 5,6-dimethyl-2-[(phenylthio)methyl]-4-[4-(2-pyrimidinyl)-1-piperazinyl]thieno[2,3-d]pyrimidine IUPAC Name: 5,6-dimethyl-2-(phenylsulfanylmethyl)-4-(4-pyrimidin-2-ylpiperazin-1-yl)thieno[2,3-d]pyrimidine Traditional Name: 5,6-dimethyl-2-[(phenylthio)methyl]-4-[4-(2-pyrimidyl)piperazino]thieno[2,3-d]pyrimidine Formula: C23H24N6S2 MolecularWeight: 448.60686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N3CCN(CC3)C4=NC=CC=N4)CSC5=CC=CC=C5)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N3CCN(CC3)C4=NC=CC=N4)CSC5=CC=CC=C5)C

InChI

InChI=1S/C23H24N6S2/c1-16-17(2)31-22-20(16)21(26-19(27-22)15-30-18-7-4-3-5-8-18)28-11-13-29(14-12-28)23-24-9-6-10-25-23/h3-10H,11-15H2,1-2H3