1-[4-(2,5-dimethylthiophen-3-yl)pyrimidin-2-yl]-5-methyl-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]pyrazole-4-carboxamide

Systemtic Name: 1-[4-(2,5-dimethylthiophen-3-yl)pyrimidin-2-yl]-5-methyl-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]pyrazole-4-carboxamide Openeye Name: 1-[4-(2,5-dimethyl-3-thienyl)pyrimidin-2-yl]-5-methyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]pyrazole-4-carboxamide CAS Name: 1-[4-(2,5-dimethyl-3-thiophenyl)-2-pyrimidinyl]-5-methyl-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-4-pyrazolecarboxamide IUPAC Name: 1-[4-(2,5-dimethylthiophen-3-yl)pyrimidin-2-yl]-5-methyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]pyrazole-4-carboxamide Traditional Name: 1-[4-(2,5-dimethyl-3-thienyl)pyrimidin-2-yl]-N-[3-(2-ketopyrrolidino)propyl]-5-methyl-pyrazole-4-carboxamide Formula: C22H26N6O2S MolecularWeight: 438.54584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C2=NC(=NC=C2)N3C(=C(C=N3)C(=O)NCCCN4CCCC4=O)C

Isomeric SMILES

CC1=CC(=C(S1)C)C2=NC(=NC=C2)N3C(=C(C=N3)C(=O)NCCCN4CCCC4=O)C

InChI

InChI=1S/C22H26N6O2S/c1-14-12-17(16(3)31-14)19-7-9-24-22(26-19)28-15(2)18(13-25-28)21(30)23-8-5-11-27-10-4-6-20(27)29/h7,9,12-13H,4-6,8,10-11H2,1-3H3,(H,23,30)