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

Systemtic Name: N-(3-piperidin-1-ylsulfonylphenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanamide Openeye Name: N-[3-(1-piperidylsulfonyl)phenyl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-acetamide CAS Name: N-[3-(1-piperidinylsulfonyl)phenyl]-2-(4-thieno[2,3-d]pyrimidinylthio)acetamide IUPAC Name: N-(3-piperidin-1-ylsulfonylphenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetamide Traditional Name: N-(3-piperidinosulfonylphenyl)-2-(thieno[2,3-d]pyrimidin-4-ylthio)acetamide Formula: C19H20N4O3S3 MolecularWeight: 448.5821

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CSC3=NC=NC4=C3C=CS4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CSC3=NC=NC4=C3C=CS4

InChI

InChI=1S/C19H20N4O3S3/c24-17(12-28-19-16-7-10-27-18(16)20-13-21-19)22-14-5-4-6-15(11-14)29(25,26)23-8-2-1-3-9-23/h4-7,10-11,13H,1-3,8-9,12H2,(H,22,24)