3-[(3,4-dimethylphenyl)sulfonylamino]-N-(1H-1,2,4-triazol-5-yl)propanimidate

Systemtic Name: 3-[(3,4-dimethylphenyl)sulfonylamino]-N-(1H-1,2,4-triazol-5-yl)propanimidate Openeye Name: 3-[(3,4-dimethylphenyl)sulfonylamino]-N-(1H-1,2,4-triazol-5-yl)propanimidate CAS Name: 3-[(3,4-dimethylphenyl)sulfonylamino]-N-(1H-1,2,4-triazol-5-yl)propanimidate IUPAC Name: 3-[(3,4-dimethylphenyl)sulfonylamino]-N-(1H-1,2,4-triazol-5-yl)propanimidate Traditional Name: 3-[(3,4-dimethylphenyl)sulfonylamino]-N-(1H-1,2,4-triazol-5-yl)propionimidate Formula: C13H16N5O3S- MolecularWeight: 322.36284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N5O3S/c1-9-3-4-11(7-10(9)2)22(20,21)16-6-5-12(19)17-13-14-8-15-18-13/h3-4,7-8,16H,5-6H2,1-2H3,(H2,14,15,17,18,19)/p-1