N-(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-bromanyl-1-ethyl-pyrazole-3-carboxamide

Systemtic Name: N-(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-bromanyl-1-ethyl-pyrazole-3-carboxamide Openeye Name: 4-bromo-N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-1-ethyl-pyrazole-3-carboxamide CAS Name: 4-bromo-N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-ethyl-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-ethylpyrazole-3-carboxamide Traditional Name: 4-bromo-N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-1-ethyl-pyrazole-3-carboxamide Formula: C15H17BrN4O2S MolecularWeight: 397.29008

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)N)Br

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)N)Br

InChI

InChI=1S/C15H17BrN4O2S/c1-2-20-7-9(16)12(19-20)14(22)18-15-11(13(17)21)8-5-3-4-6-10(8)23-15/h7H,2-6H2,1H3,(H2,17,21)(H,18,22)