N-[(3-acetamidophenyl)methyl]-1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide

Systemtic Name: N-[(3-acetamidophenyl)methyl]-1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Openeye Name: N-[(3-acetamidophenyl)methyl]-1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide CAS Name: N-[(3-acetamidophenyl)methyl]-1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide IUPAC Name: N-[(3-acetamidophenyl)methyl]-1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Traditional Name: N-(3-acetamidobenzyl)-1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Formula: C23H23FN4O2 MolecularWeight: 406.452723

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)CNC(=O)C2=NN(C3=C2CCCC3)C4=CC=C(C=C4)F

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)CNC(=O)C2=NN(C3=C2CCCC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H23FN4O2/c1-15(29)26-18-6-4-5-16(13-18)14-25-23(30)22-20-7-2-3-8-21(20)28(27-22)19-11-9-17(24)10-12-19/h4-6,9-13H,2-3,7-8,14H2,1H3,(H,25,30)(H,26,29)