4-bromanyl-N-[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1-ethyl-pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-N-[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1-ethyl-pyrazole-3-carboxamide Openeye Name: 4-bromo-N-[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl]-1-ethyl-pyrazole-3-carboxamide CAS Name: 4-bromo-N-[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1-ethyl-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1-ethylpyrazole-3-carboxamide Traditional Name: 4-bromo-N-[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl]-1-ethyl-pyrazole-3-carboxamide Formula: C19H23BrN4OS MolecularWeight: 435.38112

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC2=C(C3=C(S2)CC(CC3)C(C)(C)C)C#N)Br

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC2=C(C3=C(S2)C[C@@H](CC3)C(C)(C)C)C#N)Br

InChI

InChI=1S/C19H23BrN4OS/c1-5-24-10-14(20)16(23-24)17(25)22-18-13(9-21)12-7-6-11(19(2,3)4)8-15(12)26-18/h10-11H,5-8H2,1-4H3,(H,22,25)/t11-/m1/s1