N-[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]-5-(2-phenylethynyl)furan-2-carboxamide

Systemtic Name: N-[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]-5-(2-phenylethynyl)furan-2-carboxamide Openeye Name: N-[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]-5-(2-phenylethynyl)furan-2-carboxamide CAS Name: N-[1-(3-methoxy-3-methylbutyl)-4-pyrazolyl]-5-(2-phenylethynyl)-2-furancarboxamide IUPAC Name: N-[1-(3-methoxy-3-methylbutyl)pyrazol-4-yl]-5-(2-phenylethynyl)furan-2-carboxamide Traditional Name: N-[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]-5-(2-phenylethynyl)-2-furamide Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCN1C=C(C=N1)NC(=O)C2=CC=C(O2)C#CC3=CC=CC=C3)OC

Isomeric SMILES

CC(C)(CCN1C=C(C=N1)NC(=O)C2=CC=C(O2)C#CC3=CC=CC=C3)OC

InChI

InChI=1S/C22H23N3O3/c1-22(2,27-3)13-14-25-16-18(15-23-25)24-21(26)20-12-11-19(28-20)10-9-17-7-5-4-6-8-17/h4-8,11-12,15-16H,13-14H2,1-3H3,(H,24,26)