N'-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-2-bromanyl-N-(2-cyanoethyl)benzohydrazide

Systemtic Name: N'-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-2-bromanyl-N-(2-cyanoethyl)benzohydrazide Openeye Name: 2-bromo-N-(2-cyanoethyl)-N'-(1,1-dioxo-1,2-benzothiazol-3-yl)benzohydrazide CAS Name: 2-bromo-N-(2-cyanoethyl)-N'-(1,1-dioxo-1,2-benzothiazol-3-yl)benzohydrazide IUPAC Name: 2-bromo-N-(2-cyanoethyl)-N'-(1,1-dioxo-1,2-benzothiazol-3-yl)benzohydrazide Traditional Name: 2-bromo-N-(2-cyanoethyl)-N'-(1,1-diketo-1,2-benzothiazol-3-yl)benzohydrazide Formula: C17H13BrN4O3S MolecularWeight: 433.27912

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NS2(=O)=O)NN(CCC#N)C(=O)C3=CC=CC=C3Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=NS2(=O)=O)NN(CCC#N)C(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C17H13BrN4O3S/c18-14-8-3-1-6-12(14)17(23)22(11-5-10-19)20-16-13-7-2-4-9-15(13)26(24,25)21-16/h1-4,6-9H,5,11H2,(H,20,21)