7-chloranyl-2-(4-fluorophenyl)-5-(5-methylfuran-2-yl)-4H-1,3,4-benzotriazepine

Systemtic Name: 7-chloranyl-2-(4-fluorophenyl)-5-(5-methylfuran-2-yl)-4H-1,3,4-benzotriazepine Openeye Name: 7-chloro-2-(4-fluorophenyl)-5-(5-methyl-2-furyl)-4H-1,3,4-benzotriazepine CAS Name: 7-chloro-2-(4-fluorophenyl)-5-(5-methyl-2-furanyl)-4H-1,3,4-benzotriazepine IUPAC Name: 7-chloro-2-(4-fluorophenyl)-5-(5-methylfuran-2-yl)-4H-1,3,4-benzotriazepine Traditional Name: 7-chloro-2-(4-fluorophenyl)-5-(5-methyl-2-furyl)-4H-1,3,4-benzotriazepine Formula: C19H13ClFN3O MolecularWeight: 353.777423

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H13ClFN3O/c1-11-2-9-17(25-11)18-15-10-13(20)5-8-16(15)22-19(24-23-18)12-3-6-14(21)7-4-12/h2-10,23H,1H3