N-(6-cyano-2-methyl-pyrazolo[1,5-a]pyrimidin-7-yl)-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(6-cyano-2-methyl-pyrazolo[1,5-a]pyrimidin-7-yl)-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(6-cyano-2-methyl-pyrazolo[1,5-a]pyrimidin-7-yl)-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-(6-cyano-2-methyl-7-pyrazolo[1,5-a]pyrimidinyl)-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-(6-cyano-2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(6-cyano-2-methyl-pyrazolo[1,5-a]pyrimidin-7-yl)-1-(2-thienylsulfonyl)isonipecotamide Formula: C18H18N6O3S2 MolecularWeight: 430.50392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN2C(=C1)N=CC(=C2NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4)C#N

Isomeric SMILES

CC1=NN2C(=C1)N=CC(=C2NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4)C#N

InChI

InChI=1S/C18H18N6O3S2/c1-12-9-15-20-11-14(10-19)17(24(15)22-12)21-18(25)13-4-6-23(7-5-13)29(26,27)16-3-2-8-28-16/h2-3,8-9,11,13H,4-7H2,1H3,(H,21,25)