N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanamide

Systemtic Name: N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanamide Openeye Name: N-[4-methyl-3-(1-piperidylsulfonyl)phenyl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-acetamide CAS Name: N-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-2-(4-thieno[2,3-d]pyrimidinylthio)acetamide IUPAC Name: N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetamide Traditional Name: N-(4-methyl-3-piperidinosulfonyl-phenyl)-2-(thieno[2,3-d]pyrimidin-4-ylthio)acetamide Formula: C20H22N4O3S3 MolecularWeight: 462.60868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=NC=NC3=C2C=CS3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NC=NC3=C2C=CS3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C20H22N4O3S3/c1-14-5-6-15(11-17(14)30(26,27)24-8-3-2-4-9-24)23-18(25)12-29-20-16-7-10-28-19(16)21-13-22-20/h5-7,10-11,13H,2-4,8-9,12H2,1H3,(H,23,25)