N-[(6R)-3-aminocarbonyl-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1,5-dimethyl-pyrazole-3-carboxamide

Systemtic Name: N-[(6R)-3-aminocarbonyl-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1,5-dimethyl-pyrazole-3-carboxamide Openeye Name: N-[(6R)-3-carbamoyl-6-(1,1-dimethylpropyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-1,5-dimethyl-pyrazole-3-carboxamide CAS Name: N-[(6R)-3-carbamoyl-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: N-[(6R)-3-carbamoyl-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1,5-dimethylpyrazole-3-carboxamide Traditional Name: N-[(6R)-6-tert-amyl-3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-1,5-dimethyl-pyrazole-3-carboxamide Formula: C20H28N4O2S MolecularWeight: 388.52692

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=NN(C(=C3)C)C

Isomeric SMILES

CCC(C)(C)[C@@H]1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=NN(C(=C3)C)C

InChI

InChI=1S/C20H28N4O2S/c1-6-20(3,4)12-7-8-13-15(10-12)27-19(16(13)17(21)25)22-18(26)14-9-11(2)24(5)23-14/h9,12H,6-8,10H2,1-5H3,(H2,21,25)(H,22,26)/t12-/m1/s1