azepan-1-yl-[1-ethyl-5-[(3-fluoranyl-4-methyl-phenyl)methylamino]-4,5,6,7-tetrahydroindazol-3-yl]methanone

Systemtic Name: azepan-1-yl-[1-ethyl-5-[(3-fluoranyl-4-methyl-phenyl)methylamino]-4,5,6,7-tetrahydroindazol-3-yl]methanone Openeye Name: azepan-1-yl-[1-ethyl-5-[(3-fluoro-4-methyl-phenyl)methylamino]-4,5,6,7-tetrahydroindazol-3-yl]methanone CAS Name: 1-azepanyl-[1-ethyl-5-[(3-fluoro-4-methylphenyl)methylamino]-4,5,6,7-tetrahydroindazol-3-yl]methanone IUPAC Name: azepan-1-yl-[1-ethyl-5-[(3-fluoro-4-methylphenyl)methylamino]-4,5,6,7-tetrahydroindazol-3-yl]methanone Traditional Name: azepan-1-yl-[1-ethyl-5-[(3-fluoro-4-methyl-benzyl)amino]-4,5,6,7-tetrahydroindazol-3-yl]methanone Formula: C24H33FN4O MolecularWeight: 412.543423

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(CC(CC2)NCC3=CC(=C(C=C3)C)F)C(=N1)C(=O)N4CCCCCC4

Isomeric SMILES

CCN1C2=C(CC(CC2)NCC3=CC(=C(C=C3)C)F)C(=N1)C(=O)N4CCCCCC4

InChI

InChI=1S/C24H33FN4O/c1-3-29-22-11-10-19(26-16-18-9-8-17(2)21(25)14-18)15-20(22)23(27-29)24(30)28-12-6-4-5-7-13-28/h8-9,14,19,26H,3-7,10-13,15-16H2,1-2H3