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

Systemtic Name: 3-[azanyl-(5-methylsulfanyl-1,3-benzoxazol-2-yl)amino]propanenitrile Openeye Name: 3-[amino-(5-methylsulfanyl-1,3-benzoxazol-2-yl)amino]propanenitrile CAS Name: 3-[amino-[5-(methylthio)-1,3-benzoxazol-2-yl]amino]propanenitrile IUPAC Name: 3-[amino-(5-methylsulfanyl-1,3-benzoxazol-2-yl)amino]propanenitrile Traditional Name: 3-[amino-[5-(methylthio)-1,3-benzoxazol-2-yl]amino]propionitrile Formula: C11H12N4OS MolecularWeight: 248.30418

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(C=C1)OC(=N2)N(CCC#N)N

Isomeric SMILES

CSC1=CC2=C(C=C1)OC(=N2)N(CCC#N)N

InChI

InChI=1S/C11H12N4OS/c1-17-8-3-4-10-9(7-8)14-11(16-10)15(13)6-2-5-12/h3-4,7H,2,6,13H2,1H3