N-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-(4-fluorophenyl)imidazole-4-carboxamide

Systemtic Name: N-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-(4-fluorophenyl)imidazole-4-carboxamide Openeye Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-(4-fluorophenyl)imidazole-4-carboxamide CAS Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-(4-fluorophenyl)-4-imidazolecarboxamide IUPAC Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-(4-fluorophenyl)imidazole-4-carboxamide Traditional Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-(4-fluorophenyl)imidazole-4-carboxamide Formula: C20H17ClFN3O3 MolecularWeight: 401.818683

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)CNC(=O)C3=CN=CN3C4=CC=C(C=C4)F)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)CNC(=O)C3=CN=CN3C4=CC=C(C=C4)F)Cl)OC1

InChI

InChI=1S/C20H17ClFN3O3/c21-16-8-13(9-18-19(16)28-7-1-6-27-18)10-24-20(26)17-11-23-12-25(17)15-4-2-14(22)3-5-15/h2-5,8-9,11-12H,1,6-7,10H2,(H,24,26)