7-fluoranyl-5-(5-methylfuran-2-yl)-2-pyridin-3-yl-4H-1,3,4-benzotriazepine

Systemtic Name: 7-fluoranyl-5-(5-methylfuran-2-yl)-2-pyridin-3-yl-4H-1,3,4-benzotriazepine Openeye Name: 7-fluoro-5-(5-methyl-2-furyl)-2-(3-pyridyl)-4H-1,3,4-benzotriazepine CAS Name: 7-fluoro-5-(5-methyl-2-furanyl)-2-(3-pyridinyl)-4H-1,3,4-benzotriazepine IUPAC Name: 7-fluoro-5-(5-methylfuran-2-yl)-2-pyridin-3-yl-4H-1,3,4-benzotriazepine Traditional Name: 7-fluoro-5-(5-methyl-2-furyl)-2-(3-pyridyl)-4H-1,3,4-benzotriazepine Formula: C18H13FN4O MolecularWeight: 320.320423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=C3C=C(C=CC3=NC(=NN2)C4=CN=CC=C4)F

Isomeric SMILES

CC1=CC=C(O1)C2=C3C=C(C=CC3=NC(=NN2)C4=CN=CC=C4)F

InChI

InChI=1S/C18H13FN4O/c1-11-4-7-16(24-11)17-14-9-13(19)5-6-15(14)21-18(23-22-17)12-3-2-8-20-10-12/h2-10,22H,1H3