3-[azanyl-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]propanenitrile

Systemtic Name: 3-[azanyl-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]propanenitrile Openeye Name: 3-[amino-(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanenitrile CAS Name: 3-[amino-(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanenitrile IUPAC Name: 3-[amino-(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanenitrile Traditional Name: 3-[amino-(1,1-diketo-1,2-benzothiazol-3-yl)amino]propionitrile Formula: C10H10N4O2S MolecularWeight: 250.277

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10N4O2S/c11-6-3-7-14(12)10-8-4-1-2-5-9(8)17(15,16)13-10/h1-2,4-5H,3,7,12H2