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

Systemtic Name: 3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(2-methyl-4-oxidanylidene-6-propyl-thieno[2,3-d]pyrimidin-3-yl)benzamide Openeye Name: 3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(2-methyl-4-oxo-6-propyl-thieno[2,3-d]pyrimidin-3-yl)benzamide CAS Name: 3-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-N-(2-methyl-4-oxo-6-propyl-3-thieno[2,3-d]pyrimidinyl)benzamide IUPAC Name: 3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(2-methyl-4-oxo-6-propylthieno[2,3-d]pyrimidin-3-yl)benzamide Traditional Name: 3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(4-keto-2-methyl-6-propyl-thieno[2,3-d]pyrimidin-3-yl)benzamide Formula: C23H24BrN5O2S MolecularWeight: 514.43796

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24BrN5O2S/c1-5-7-18-11-19-22(32-18)25-15(4)29(23(19)31)27-21(30)17-9-6-8-16(10-17)12-28-14(3)20(24)13(2)26-28/h6,8-11H,5,7,12H2,1-4H3,(H,27,30)