N-[2-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)-5-phenyl-pyrazol-3-yl]-1-methylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)-5-phenyl-pyrazol-3-yl]-1-methylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-phenyl-pyrazol-3-yl]-1-methylsulfonyl-piperidine-4-carboxamide CAS Name: N-[2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-phenyl-3-pyrazolyl]-1-methylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-phenylpyrazol-3-yl]-1-methylsulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(4-keto-6-methyl-1H-pyrimidin-2-yl)-5-phenyl-pyrazol-3-yl]-1-mesyl-isonipecotamide Formula: C21H24N6O4S MolecularWeight: 456.51806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CC=C3)NC(=O)C4CCN(CC4)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CC=C3)NC(=O)C4CCN(CC4)S(=O)(=O)C

InChI

InChI=1S/C21H24N6O4S/c1-14-12-19(28)24-21(22-14)27-18(13-17(25-27)15-6-4-3-5-7-15)23-20(29)16-8-10-26(11-9-16)32(2,30)31/h3-7,12-13,16H,8-11H2,1-2H3,(H,23,29)(H,22,24,28)