2-[7-bromanyl-1-methyl-2,4-bis(oxidanylidene)-1,5-benzodiazepin-5-yl]benzenecarbonitrile

Systemtic Name: 2-[7-bromanyl-1-methyl-2,4-bis(oxidanylidene)-1,5-benzodiazepin-5-yl]benzenecarbonitrile Openeye Name: 2-(7-bromo-1-methyl-2,4-dioxo-1,5-benzodiazepin-5-yl)benzonitrile CAS Name: 2-(7-bromo-1-methyl-2,4-dioxo-1,5-benzodiazepin-5-yl)benzonitrile IUPAC Name: 2-(7-bromo-1-methyl-2,4-dioxo-1,5-benzodiazepin-5-yl)benzonitrile Traditional Name: 2-(7-bromo-2,4-diketo-1-methyl-1,5-benzodiazepin-5-yl)benzonitrile Formula: C17H12BrN3O2 MolecularWeight: 370.20008

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CC(=O)N(C2=C1C=CC(=C2)Br)C3=CC=CC=C3C#N

Isomeric SMILES

CN1C(=O)CC(=O)N(C2=C1C=CC(=C2)Br)C3=CC=CC=C3C#N

InChI

InChI=1S/C17H12BrN3O2/c1-20-14-7-6-12(18)8-15(14)21(17(23)9-16(20)22)13-5-3-2-4-11(13)10-19/h2-8H,9H2,1H3