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

Systemtic Name: 7-fluoranyl-5-(5-methylfuran-2-yl)-2-(4-propan-2-ylphenyl)-4H-1,3,4-benzotriazepine Openeye Name: 7-fluoro-2-(4-isopropylphenyl)-5-(5-methyl-2-furyl)-4H-1,3,4-benzotriazepine CAS Name: 7-fluoro-5-(5-methyl-2-furanyl)-2-(4-propan-2-ylphenyl)-4H-1,3,4-benzotriazepine IUPAC Name: 7-fluoro-5-(5-methylfuran-2-yl)-2-(4-propan-2-ylphenyl)-4H-1,3,4-benzotriazepine Traditional Name: 7-fluoro-5-(5-methyl-2-furyl)-2-p-cumenyl-4H-1,3,4-benzotriazepine Formula: C22H20FN3O MolecularWeight: 361.412103

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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)C(C)C)F

Isomeric SMILES

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

InChI

InChI=1S/C22H20FN3O/c1-13(2)15-5-7-16(8-6-15)22-24-19-10-9-17(23)12-18(19)21(25-26-22)20-11-4-14(3)27-20/h4-13,25H,1-3H3