3-[azanyl-(1-oxidanidyl-1-oxidanylidene-4,5,6,7-tetrahydro-1,2-benzothiazol-3-yl)amino]propanenitrile

Systemtic Name: 3-[azanyl-(1-oxidanidyl-1-oxidanylidene-4,5,6,7-tetrahydro-1,2-benzothiazol-3-yl)amino]propanenitrile Openeye Name: 3-[amino-(1-oxido-1-oxo-4,5,6,7-tetrahydro-1,2-benzothiazol-3-yl)amino]propanenitrile CAS Name: 3-[amino-(1-oxido-1-oxo-4,5,6,7-tetrahydro-1,2-benzothiazol-3-yl)amino]propanenitrile IUPAC Name: 3-[amino-(1-oxido-1-oxo-4,5,6,7-tetrahydro-1,2-benzothiazol-3-yl)amino]propanenitrile Traditional Name: 3-[amino-(1-keto-1-oxido-4,5,6,7-tetrahydro-1,2-benzothiazol-3-yl)amino]propionitrile Formula: C10H14N4O2S MolecularWeight: 254.30876

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=N[S+]2(=O)[O-])N(CCC#N)N

Isomeric SMILES

C1CCC2=C(C1)C(=N[S+]2(=O)[O-])N(CCC#N)N

InChI

InChI=1S/C10H14N4O2S/c11-6-3-7-14(12)10-8-4-1-2-5-9(8)17(15,16)13-10/h1-5,7,12H2