7-bromanyl-1-[2-(3,5-dimethylpyrazol-1-yl)-2-oxidanylidene-ethyl]-5-phenyl-3H-1,4-benzodiazepin-2-one

Systemtic Name: 7-bromanyl-1-[2-(3,5-dimethylpyrazol-1-yl)-2-oxidanylidene-ethyl]-5-phenyl-3H-1,4-benzodiazepin-2-one Openeye Name: 7-bromo-1-[2-(3,5-dimethylpyrazol-1-yl)-2-oxo-ethyl]-5-phenyl-3H-1,4-benzodiazepin-2-one CAS Name: 7-bromo-1-[2-(3,5-dimethyl-1-pyrazolyl)-2-oxoethyl]-5-phenyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 7-bromo-1-[2-(3,5-dimethylpyrazol-1-yl)-2-oxoethyl]-5-phenyl-3H-1,4-benzodiazepin-2-one Traditional Name: 7-bromo-1-[2-(3,5-dimethylpyrazol-1-yl)-2-keto-ethyl]-5-phenyl-3H-1,4-benzodiazepin-2-one Formula: C22H19BrN4O2 MolecularWeight: 451.31586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=O)CN2C(=O)CN=C(C3=C2C=CC(=C3)Br)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=NN1C(=O)CN2C(=O)CN=C(C3=C2C=CC(=C3)Br)C4=CC=CC=C4)C

InChI

InChI=1S/C22H19BrN4O2/c1-14-10-15(2)27(25-14)21(29)13-26-19-9-8-17(23)11-18(19)22(24-12-20(26)28)16-6-4-3-5-7-16/h3-11H,12-13H2,1-2H3