8-bromanyl-4-(4-fluorophenyl)-2-(5-methylfuran-2-yl)-1H-1,3,5-benzotriazepine

Systemtic Name: 8-bromanyl-4-(4-fluorophenyl)-2-(5-methylfuran-2-yl)-1H-1,3,5-benzotriazepine Openeye Name: 8-bromo-4-(4-fluorophenyl)-2-(5-methyl-2-furyl)-1H-1,3,5-benzotriazepine CAS Name: 8-bromo-4-(4-fluorophenyl)-2-(5-methyl-2-furanyl)-1H-1,3,5-benzotriazepine IUPAC Name: 8-bromo-4-(4-fluorophenyl)-2-(5-methylfuran-2-yl)-1H-1,3,5-benzotriazepine Traditional Name: 8-bromo-4-(4-fluorophenyl)-2-(5-methyl-2-furyl)-1H-1,3,5-benzotriazepine Formula: C19H13BrFN3O MolecularWeight: 398.228423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=NC(=NC3=C(N2)C=C(C=C3)Br)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC=C(O1)C2=NC(=NC3=C(N2)C=C(C=C3)Br)C4=CC=C(C=C4)F

InChI

InChI=1S/C19H13BrFN3O/c1-11-2-9-17(25-11)19-23-16-10-13(20)5-8-15(16)22-18(24-19)12-3-6-14(21)7-4-12/h2-10H,1H3,(H,22,23,24)