dimethyl sulfate; N-ethyl-4-[(4-methyl-1,2,4-triazol-3-yl)diazenyl]-N-(phenylmethyl)aniline

Systemtic Name: dimethyl sulfate; N-ethyl-4-[(4-methyl-1,2,4-triazol-3-yl)diazenyl]-N-(phenylmethyl)aniline Openeye Name: N-benzyl-N-ethyl-4-[(4-methyl-1,2,4-triazol-3-yl)azo]aniline; dimethyl sulfate CAS Name: N-ethyl-4-[(4-methyl-1,2,4-triazol-3-yl)azo]-N-(phenylmethyl)aniline; sulfuric acid dimethyl ester IUPAC Name: N-benzyl-N-ethyl-4-[(4-methyl-1,2,4-triazol-3-yl)diazenyl]aniline; dimethyl sulfate Traditional Name: benzyl-ethyl-[4-[(4-methyl-1,2,4-triazol-3-yl)azo]phenyl]amine; sulfuric acid dimethyl ester Formula: C20H26N6O4S MolecularWeight: 446.52324

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=NN=CN3C.COS(=O)(=O)OC

Isomeric SMILES

CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=NN=CN3C.COS(=O)(=O)OC

InChI

InChI=1S/C18H20N6.C2H6O4S/c1-3-24(13-15-7-5-4-6-8-15)17-11-9-16(10-12-17)20-22-18-21-19-14-23(18)2;1-5-7(3,4)6-2/h4-12,14H,3,13H2,1-2H3;1-2H3