5-bromanyl-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-methylsulfonyl-pyrimidine-4-carboxamide

Systemtic Name: 5-bromanyl-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-methylsulfonyl-pyrimidine-4-carboxamide Openeye Name: 5-bromo-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-methylsulfonyl-pyrimidine-4-carboxamide CAS Name: 5-bromo-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-methylsulfonyl-4-pyrimidinecarboxamide IUPAC Name: 5-bromo-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-methylsulfonylpyrimidine-4-carboxamide Traditional Name: 5-bromo-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-mesyl-pyrimidine-4-carboxamide Formula: C15H13BrN4O3S2 MolecularWeight: 441.32272

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NC=C(C(=N1)C(=O)NC2=C(C3=C(S2)CCCC3)C#N)Br

Isomeric SMILES

CS(=O)(=O)C1=NC=C(C(=N1)C(=O)NC2=C(C3=C(S2)CCCC3)C#N)Br

InChI

InChI=1S/C15H13BrN4O3S2/c1-25(22,23)15-18-7-10(16)12(19-15)13(21)20-14-9(6-17)8-4-2-3-5-11(8)24-14/h7H,2-5H2,1H3,(H,20,21)