1-[[4-(azepan-1-yl)-3-fluoranyl-phenyl]methyl]-3-(1-methylindazol-4-yl)urea

Systemtic Name: 1-[[4-(azepan-1-yl)-3-fluoranyl-phenyl]methyl]-3-(1-methylindazol-4-yl)urea Openeye Name: 1-[[4-(azepan-1-yl)-3-fluoro-phenyl]methyl]-3-(1-methylindazol-4-yl)urea CAS Name: 1-[[4-(1-azepanyl)-3-fluorophenyl]methyl]-3-(1-methyl-4-indazolyl)urea IUPAC Name: 1-[[4-(azepan-1-yl)-3-fluorophenyl]methyl]-3-(1-methylindazol-4-yl)urea Traditional Name: 1-[4-(azepan-1-yl)-3-fluoro-benzyl]-3-(1-methylindazol-4-yl)urea Formula: C22H26FN5O MolecularWeight: 395.473143

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=CC=C2)NC(=O)NCC3=CC(=C(C=C3)N4CCCCCC4)F

Isomeric SMILES

CN1C2=C(C=N1)C(=CC=C2)NC(=O)NCC3=CC(=C(C=C3)N4CCCCCC4)F

InChI

InChI=1S/C22H26FN5O/c1-27-20-8-6-7-19(17(20)15-25-27)26-22(29)24-14-16-9-10-21(18(23)13-16)28-11-4-2-3-5-12-28/h6-10,13,15H,2-5,11-12,14H2,1H3,(H2,24,26,29)