4-methyl-6-methylsulfanyl-N-(3-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-yl-pyrimidine-5-carboxamide

Systemtic Name: 4-methyl-6-methylsulfanyl-N-(3-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-yl-pyrimidine-5-carboxamide Openeye Name: 4-methyl-6-methylsulfanyl-N-[3-(1-piperidylsulfonyl)phenyl]-2-(2-thienyl)pyrimidine-5-carboxamide CAS Name: 4-methyl-6-(methylthio)-N-[3-(1-piperidinylsulfonyl)phenyl]-2-thiophen-2-yl-5-pyrimidinecarboxamide IUPAC Name: 4-methyl-6-methylsulfanyl-N-(3-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylpyrimidine-5-carboxamide Traditional Name: 4-methyl-6-(methylthio)-N-(3-piperidinosulfonylphenyl)-2-(2-thienyl)pyrimidine-5-carboxamide Formula: C22H24N4O3S3 MolecularWeight: 488.64596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2=CC=CS2)SC)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=CS2)SC)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C22H24N4O3S3/c1-15-19(22(30-2)25-20(23-15)18-10-7-13-31-18)21(27)24-16-8-6-9-17(14-16)32(28,29)26-11-4-3-5-12-26/h6-10,13-14H,3-5,11-12H2,1-2H3,(H,24,27)