3-methyl-N-[3-(3-thiophen-2-ylcarbonylpyrazolo[1,5-a]pyrimidin-7-yl)phenyl]but-2-enamide

Systemtic Name: 3-methyl-N-[3-(3-thiophen-2-ylcarbonylpyrazolo[1,5-a]pyrimidin-7-yl)phenyl]but-2-enamide Openeye Name: 3-methyl-N-[3-[3-(thiophene-2-carbonyl)pyrazolo[1,5-a]pyrimidin-7-yl]phenyl]but-2-enamide CAS Name: 3-methyl-N-[3-[3-[oxo(thiophen-2-yl)methyl]-7-pyrazolo[1,5-a]pyrimidinyl]phenyl]-2-butenamide IUPAC Name: 3-methyl-N-[3-[3-(thiophene-2-carbonyl)pyrazolo[1,5-a]pyrimidin-7-yl]phenyl]but-2-enamide Traditional Name: 3-methyl-N-[3-[3-(2-thenoyl)pyrazolo[1,5-a]pyrimidin-7-yl]phenyl]but-2-enamide Formula: C22H18N4O2S MolecularWeight: 402.46892

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=CC=CC(=C1)C2=CC=NC3=C(C=NN23)C(=O)C4=CC=CS4)C

Isomeric SMILES

CC(=CC(=O)NC1=CC=CC(=C1)C2=CC=NC3=C(C=NN23)C(=O)C4=CC=CS4)C

InChI

InChI=1S/C22H18N4O2S/c1-14(2)11-20(27)25-16-6-3-5-15(12-16)18-8-9-23-22-17(13-24-26(18)22)21(28)19-7-4-10-29-19/h3-13H,1-2H3,(H,25,27)