5-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(2-methyl-4-oxidanylidene-6-propyl-thieno[2,3-d]pyrimidin-3-yl)furan-2-carboxamide

Systemtic Name: 5-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(2-methyl-4-oxidanylidene-6-propyl-thieno[2,3-d]pyrimidin-3-yl)furan-2-carboxamide Openeye Name: 5-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(2-methyl-4-oxo-6-propyl-thieno[2,3-d]pyrimidin-3-yl)furan-2-carboxamide CAS Name: 5-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-N-(2-methyl-4-oxo-6-propyl-3-thieno[2,3-d]pyrimidinyl)-2-furancarboxamide IUPAC Name: 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(2-methyl-4-oxo-6-propylthieno[2,3-d]pyrimidin-3-yl)furan-2-carboxamide Traditional Name: 5-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(4-keto-2-methyl-6-propyl-thieno[2,3-d]pyrimidin-3-yl)-2-furamide Formula: C21H22BrN5O3S MolecularWeight: 504.40008

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC2=C(S1)N=C(N(C2=O)NC(=O)C3=CC=C(O3)CN4C(=C(C(=N4)C)Br)C)C

Isomeric SMILES

CCCC1=CC2=C(S1)N=C(N(C2=O)NC(=O)C3=CC=C(O3)CN4C(=C(C(=N4)C)Br)C)C

InChI

InChI=1S/C21H22BrN5O3S/c1-5-6-15-9-16-20(31-15)23-13(4)27(21(16)29)25-19(28)17-8-7-14(30-17)10-26-12(3)18(22)11(2)24-26/h7-9H,5-6,10H2,1-4H3,(H,25,28)