3-[azanyl-(5,6-dimethyl-1,3-benzoxazol-2-yl)amino]propanenitrile

Systemtic Name: 3-[azanyl-(5,6-dimethyl-1,3-benzoxazol-2-yl)amino]propanenitrile Openeye Name: 3-[amino-(5,6-dimethyl-1,3-benzoxazol-2-yl)amino]propanenitrile CAS Name: 3-[amino-(5,6-dimethyl-1,3-benzoxazol-2-yl)amino]propanenitrile IUPAC Name: 3-[amino-(5,6-dimethyl-1,3-benzoxazol-2-yl)amino]propanenitrile Traditional Name: 3-[amino-(5,6-dimethyl-1,3-benzoxazol-2-yl)amino]propionitrile Formula: C12H14N4O MolecularWeight: 230.26576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)OC(=N2)N(CCC#N)N

Isomeric SMILES

CC1=CC2=C(C=C1C)OC(=N2)N(CCC#N)N

InChI

InChI=1S/C12H14N4O/c1-8-6-10-11(7-9(8)2)17-12(15-10)16(14)5-3-4-13/h6-7H,3,5,14H2,1-2H3