5-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[3-cyano-5-(diethylcarbamoyl)-4-methyl-thiophen-2-yl]furan-2-carboxamide

Systemtic Name: 5-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[3-cyano-5-(diethylcarbamoyl)-4-methyl-thiophen-2-yl]furan-2-carboxamide Openeye Name: 5-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[3-cyano-5-(diethylcarbamoyl)-4-methyl-2-thienyl]furan-2-carboxamide CAS Name: 5-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-N-[3-cyano-5-[diethylamino(oxo)methyl]-4-methyl-2-thiophenyl]-2-furancarboxamide IUPAC Name: 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-[3-cyano-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]furan-2-carboxamide Traditional Name: 5-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[3-cyano-5-(diethylcarbamoyl)-4-methyl-2-thienyl]-2-furamide Formula: C22H24BrN5O3S MolecularWeight: 518.42666

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC=C(O2)CN3C(=C(C(=N3)C)Br)C)C#N)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC=C(O2)CN3C(=C(C(=N3)C)Br)C)C#N)C

InChI

InChI=1S/C22H24BrN5O3S/c1-6-27(7-2)22(30)19-12(3)16(10-24)21(32-19)25-20(29)17-9-8-15(31-17)11-28-14(5)18(23)13(4)26-28/h8-9H,6-7,11H2,1-5H3,(H,25,29)