3-[methyl-[4-[(3-methyl-1,3-thiazol-3-ium-2-yl)diazenyl]phenyl]amino]propanenitrile

Systemtic Name: 3-[methyl-[4-[(3-methyl-1,3-thiazol-3-ium-2-yl)diazenyl]phenyl]amino]propanenitrile Openeye Name: 3-[N-methyl-4-(3-methylthiazol-3-ium-2-yl)azo-anilino]propanenitrile CAS Name: 3-[N-methyl-4-[(3-methyl-2-thiazol-3-iumyl)azo]anilino]propanenitrile IUPAC Name: 3-[N-methyl-4-[(3-methyl-1,3-thiazol-3-ium-2-yl)diazenyl]anilino]propanenitrile Traditional Name: 3-[N-methyl-4-(3-methylthiazol-3-ium-2-yl)azo-anilino]propionitrile Formula: C14H16N5S+ MolecularWeight: 286.37534

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(SC=C1)N=NC2=CC=C(C=C2)N(C)CCC#N

Isomeric SMILES

C[N+]1=C(SC=C1)N=NC2=CC=C(C=C2)N(C)CCC#N

InChI

InChI=1S/C14H16N5S/c1-18(9-3-8-15)13-6-4-12(5-7-13)16-17-14-19(2)10-11-20-14/h4-7,10-11H,3,9H2,1-2H3/q+1