N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide

Systemtic Name: N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Openeye Name: N-(3-cyano-4,5-dimethyl-2-thienyl)-1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide CAS Name: N-(3-cyano-4,5-dimethyl-2-thiophenyl)-1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide IUPAC Name: N-(3-cyano-4,5-dimethylthiophen-2-yl)-1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Traditional Name: N-(3-cyano-4,5-dimethyl-2-thienyl)-1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Formula: C21H19FN4OS MolecularWeight: 394.465163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C2=NN(C3=C2CCCC3)C4=CC=C(C=C4)F)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C2=NN(C3=C2CCCC3)C4=CC=C(C=C4)F)C

InChI

InChI=1S/C21H19FN4OS/c1-12-13(2)28-21(17(12)11-23)24-20(27)19-16-5-3-4-6-18(16)26(25-19)15-9-7-14(22)8-10-15/h7-10H,3-6H2,1-2H3,(H,24,27)