1-[4-(2,5-dimethylthiophen-3-yl)pyrimidin-2-yl]-5-(methoxymethyl)-N-(2-oxidanylbutyl)pyrazole-4-carboxamide

Systemtic Name: 1-[4-(2,5-dimethylthiophen-3-yl)pyrimidin-2-yl]-5-(methoxymethyl)-N-(2-oxidanylbutyl)pyrazole-4-carboxamide Openeye Name: 1-[4-(2,5-dimethyl-3-thienyl)pyrimidin-2-yl]-N-(2-hydroxybutyl)-5-(methoxymethyl)pyrazole-4-carboxamide CAS Name: 1-[4-(2,5-dimethyl-3-thiophenyl)-2-pyrimidinyl]-N-(2-hydroxybutyl)-5-(methoxymethyl)-4-pyrazolecarboxamide IUPAC Name: 1-[4-(2,5-dimethylthiophen-3-yl)pyrimidin-2-yl]-N-(2-hydroxybutyl)-5-(methoxymethyl)pyrazole-4-carboxamide Traditional Name: 1-[4-(2,5-dimethyl-3-thienyl)pyrimidin-2-yl]-N-(2-hydroxybutyl)-5-(methoxymethyl)pyrazole-4-carboxamide Formula: C20H25N5O3S MolecularWeight: 415.5092

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)C1=C(N(N=C1)C2=NC=CC(=N2)C3=C(SC(=C3)C)C)COC)O

Isomeric SMILES

CCC(CNC(=O)C1=C(N(N=C1)C2=NC=CC(=N2)C3=C(SC(=C3)C)C)COC)O

InChI

InChI=1S/C20H25N5O3S/c1-5-14(26)9-22-19(27)16-10-23-25(18(16)11-28-4)20-21-7-6-17(24-20)15-8-12(2)29-13(15)3/h6-8,10,14,26H,5,9,11H2,1-4H3,(H,22,27)