5-methyl-6-phenyl-4-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-thieno[2,3-d]pyrimidine

Systemtic Name: 5-methyl-6-phenyl-4-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-thieno[2,3-d]pyrimidine Openeye Name: 5-methyl-6-phenyl-4-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanyl]thieno[2,3-d]pyrimidine CAS Name: 5-methyl-6-phenyl-4-[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]thieno[2,3-d]pyrimidine IUPAC Name: 5-methyl-6-phenyl-4-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylthieno[2,3-d]pyrimidine Traditional Name: 5-methyl-6-phenyl-4-[(5-piperidinosulfonyl-2-pyridyl)thio]thieno[2,3-d]pyrimidine Formula: C23H22N4O2S3 MolecularWeight: 482.64138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC=N2)SC3=NC=C(C=C3)S(=O)(=O)N4CCCCC4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(SC2=C1C(=NC=N2)SC3=NC=C(C=C3)S(=O)(=O)N4CCCCC4)C5=CC=CC=C5

InChI

InChI=1S/C23H22N4O2S3/c1-16-20-22(25-15-26-23(20)31-21(16)17-8-4-2-5-9-17)30-19-11-10-18(14-24-19)32(28,29)27-12-6-3-7-13-27/h2,4-5,8-11,14-15H,3,6-7,12-13H2,1H3