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

Systemtic Name: 3-azanyl-1-(3,3-dimethyl-2-oxidanylidene-butyl)-5-methyl-3H-1,4-benzodiazepin-2-one Openeye Name: 3-amino-1-(3,3-dimethyl-2-oxo-butyl)-5-methyl-3H-1,4-benzodiazepin-2-one CAS Name: 3-amino-1-(3,3-dimethyl-2-oxobutyl)-5-methyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 3-amino-1-(3,3-dimethyl-2-oxobutyl)-5-methyl-3H-1,4-benzodiazepin-2-one Traditional Name: 3-amino-1-(2-keto-3,3-dimethyl-butyl)-5-methyl-3H-1,4-benzodiazepin-2-one Formula: C16H21N3O2 MolecularWeight: 287.35684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(C(=O)N(C2=CC=CC=C12)CC(=O)C(C)(C)C)N

Isomeric SMILES

CC1=NC(C(=O)N(C2=CC=CC=C12)CC(=O)C(C)(C)C)N

InChI

InChI=1S/C16H21N3O2/c1-10-11-7-5-6-8-12(11)19(15(21)14(17)18-10)9-13(20)16(2,3)4/h5-8,14H,9,17H2,1-4H3