7-(dimethylamino)-8-fluoranyl-4-[3-[5-(hydroxymethyl)-1,2,3-triazol-1-yl]phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one

Systemtic Name: 7-(dimethylamino)-8-fluoranyl-4-[3-[5-(hydroxymethyl)-1,2,3-triazol-1-yl]phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one Openeye Name: 7-(dimethylamino)-8-fluoro-4-[3-[5-(hydroxymethyl)triazol-1-yl]phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one CAS Name: 7-(dimethylamino)-8-fluoro-4-[3-[5-(hydroxymethyl)-1-triazolyl]phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one IUPAC Name: 7-(dimethylamino)-8-fluoro-4-[3-[5-(hydroxymethyl)triazol-1-yl]phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one Traditional Name: 7-(dimethylamino)-8-fluoro-4-[3-(5-methyloltriazol-1-yl)phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one Formula: C20H19FN6O2 MolecularWeight: 394.402263

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C2C(=C1)N=C(CC(=O)N2)C3=CC(=CC=C3)N4C(=CN=N4)CO)F

Isomeric SMILES

CN(C)C1=C(C=C2C(=C1)N=C(CC(=O)N2)C3=CC(=CC=C3)N4C(=CN=N4)CO)F

InChI

InChI=1S/C20H19FN6O2/c1-26(2)19-8-18-17(7-15(19)21)24-20(29)9-16(23-18)12-4-3-5-13(6-12)27-14(11-28)10-22-25-27/h3-8,10,28H,9,11H2,1-2H3,(H,24,29)