3-[azanyl-(4,5,7-trimethyl-1,3-benzoxazol-2-yl)amino]propanenitrile

Systemtic Name: 3-[azanyl-(4,5,7-trimethyl-1,3-benzoxazol-2-yl)amino]propanenitrile Openeye Name: 3-[amino-(4,5,7-trimethyl-1,3-benzoxazol-2-yl)amino]propanenitrile CAS Name: 3-[amino-(4,5,7-trimethyl-1,3-benzoxazol-2-yl)amino]propanenitrile IUPAC Name: 3-[amino-(4,5,7-trimethyl-1,3-benzoxazol-2-yl)amino]propanenitrile Traditional Name: 3-[amino-(4,5,7-trimethyl-1,3-benzoxazol-2-yl)amino]propionitrile Formula: C13H16N4O MolecularWeight: 244.29234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1C)N=C(O2)N(CCC#N)N)C

Isomeric SMILES

CC1=CC(=C2C(=C1C)N=C(O2)N(CCC#N)N)C

InChI

InChI=1S/C13H16N4O/c1-8-7-9(2)12-11(10(8)3)16-13(18-12)17(15)6-4-5-14/h7H,4,6,15H2,1-3H3