2-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]-N-(1H-1,2,4-triazol-5-yl)ethanimidate

Systemtic Name: 2-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]-N-(1H-1,2,4-triazol-5-yl)ethanimidate Openeye Name: 2-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]-N-(1H-1,2,4-triazol-5-yl)ethanimidate CAS Name: 2-[(3,4-dimethylphenyl)sulfonyl-methylamino]-N-(1H-1,2,4-triazol-5-yl)ethanimidate IUPAC Name: 2-[(3,4-dimethylphenyl)sulfonyl-methylamino]-N-(1H-1,2,4-triazol-5-yl)ethanimidate Traditional Name: 2-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]-N-(1H-1,2,4-triazol-5-yl)acetimidate Formula: C13H16N5O3S- MolecularWeight: 322.36284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)CC(=NC2=NC=NN2)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)CC(=NC2=NC=NN2)[O-])C

InChI

InChI=1S/C13H17N5O3S/c1-9-4-5-11(6-10(9)2)22(20,21)18(3)7-12(19)16-13-14-8-15-17-13/h4-6,8H,7H2,1-3H3,(H2,14,15,16,17,19)/p-1