2-(4-bromanyl-3-methyl-pyrazol-1-yl)-N-[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]ethanamide

Systemtic Name: 2-(4-bromanyl-3-methyl-pyrazol-1-yl)-N-[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]ethanamide Openeye Name: 2-(4-bromo-3-methyl-pyrazol-1-yl)-N-[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl]acetamide CAS Name: 2-(4-bromo-3-methyl-1-pyrazolyl)-N-[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]acetamide IUPAC Name: 2-(4-bromo-3-methylpyrazol-1-yl)-N-[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]acetamide Traditional Name: 2-(4-bromo-3-methyl-pyrazol-1-yl)-N-[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl]acetamide Formula: C19H23BrN4OS MolecularWeight: 435.38112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1Br)CC(=O)NC2=C(C3=C(S2)CC(CC3)C(C)(C)C)C#N

Isomeric SMILES

CC1=NN(C=C1Br)CC(=O)NC2=C(C3=C(S2)C[C@@H](CC3)C(C)(C)C)C#N

InChI

InChI=1S/C19H23BrN4OS/c1-11-15(20)9-24(23-11)10-17(25)22-18-14(8-21)13-6-5-12(19(2,3)4)7-16(13)26-18/h9,12H,5-7,10H2,1-4H3,(H,22,25)/t12-/m1/s1