4-[(2,4-dimethyl-3H-1,2,4-triazol-3-yl)diazenyl]-N,N-diethyl-aniline; methyl hydrogen sulfate

Systemtic Name: 4-[(2,4-dimethyl-3H-1,2,4-triazol-3-yl)diazenyl]-N,N-diethyl-aniline; methyl hydrogen sulfate Openeye Name: 4-[(2,4-dimethyl-3H-1,2,4-triazol-3-yl)azo]-N,N-diethyl-aniline; methyl hydrogen sulfate CAS Name: 4-[(2,4-dimethyl-3H-1,2,4-triazol-3-yl)azo]-N,N-diethylaniline; sulfuric acid methyl ester IUPAC Name: 4-[(2,4-dimethyl-3H-1,2,4-triazol-3-yl)diazenyl]-N,N-diethylaniline; methyl hydrogen sulfate Traditional Name: [4-[(2,4-dimethyl-3H-1,2,4-triazol-3-yl)azo]phenyl]-diethyl-amine; sulfuric acid methyl ester Formula: C15H26N6O4S MolecularWeight: 386.46974

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)N=NC2N(C=NN2C)C.COS(=O)(=O)O

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)N=NC2N(C=NN2C)C.COS(=O)(=O)O

InChI

InChI=1S/C14H22N6.CH4O4S/c1-5-20(6-2)13-9-7-12(8-10-13)16-17-14-18(3)11-15-19(14)4;1-5-6(2,3)4/h7-11,14H,5-6H2,1-4H3;1H3,(H,2,3,4)