3-azanyl-1-(3,3-dimethyl-2-oxidanylidene-butyl)-5-(2-fluorophenyl)-9-methyl-3H-1,4-benzodiazepin-2-one

Systemtic Name: 3-azanyl-1-(3,3-dimethyl-2-oxidanylidene-butyl)-5-(2-fluorophenyl)-9-methyl-3H-1,4-benzodiazepin-2-one Openeye Name: 3-amino-1-(3,3-dimethyl-2-oxo-butyl)-5-(2-fluorophenyl)-9-methyl-3H-1,4-benzodiazepin-2-one CAS Name: 3-amino-1-(3,3-dimethyl-2-oxobutyl)-5-(2-fluorophenyl)-9-methyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 3-amino-1-(3,3-dimethyl-2-oxobutyl)-5-(2-fluorophenyl)-9-methyl-3H-1,4-benzodiazepin-2-one Traditional Name: 3-amino-5-(2-fluorophenyl)-1-(2-keto-3,3-dimethyl-butyl)-9-methyl-3H-1,4-benzodiazepin-2-one Formula: C22H24FN3O2 MolecularWeight: 381.443263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N(C(=O)C(N=C2C3=CC=CC=C3F)N)CC(=O)C(C)(C)C

Isomeric SMILES

CC1=CC=CC2=C1N(C(=O)C(N=C2C3=CC=CC=C3F)N)CC(=O)C(C)(C)C

InChI

InChI=1S/C22H24FN3O2/c1-13-8-7-10-15-18(14-9-5-6-11-16(14)23)25-20(24)21(28)26(19(13)15)12-17(27)22(2,3)4/h5-11,20H,12,24H2,1-4H3