2-[1,1-bis(oxidanylidene)-4H-1$l^{6},2,4-benzothiadiazin-3-yl]ethanenitrile

Systemtic Name: 2-[1,1-bis(oxidanylidene)-4H-1$l^{6},2,4-benzothiadiazin-3-yl]ethanenitrile Openeye Name: 2-(1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-3-yl)acetonitrile CAS Name: 2-(1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-3-yl)acetonitrile IUPAC Name: 2-(1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-3-yl)acetonitrile Traditional Name: 2-(1,1-diketo-4H-1$l^{6},2,4-benzothiadiazin-3-yl)acetonitrile Formula: C9H7N3O2S MolecularWeight: 221.23578

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=NS2(=O)=O)CC#N

Isomeric SMILES

C1=CC=C2C(=C1)NC(=NS2(=O)=O)CC#N

InChI

InChI=1S/C9H7N3O2S/c10-6-5-9-11-7-3-1-2-4-8(7)15(13,14)12-9/h1-4H,5H2,(H,11,12)