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

Systemtic Name: 3-[(4-ethanoylphenyl)sulfonylamino]-N-(1H-1,2,4-triazol-5-yl)propanimidate Openeye Name: 3-[(4-acetylphenyl)sulfonylamino]-N-(1H-1,2,4-triazol-5-yl)propanimidate CAS Name: 3-[(4-acetylphenyl)sulfonylamino]-N-(1H-1,2,4-triazol-5-yl)propanimidate IUPAC Name: 3-[(4-acetylphenyl)sulfonylamino]-N-(1H-1,2,4-triazol-5-yl)propanimidate Traditional Name: 3-[(4-acetylphenyl)sulfonylamino]-N-(1H-1,2,4-triazol-5-yl)propionimidate Formula: C13H14N5O4S- MolecularWeight: 336.34636

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15N5O4S/c1-9(19)10-2-4-11(5-3-10)23(21,22)16-7-6-12(20)17-13-14-8-15-18-13/h2-5,8,16H,6-7H2,1H3,(H2,14,15,17,18,20)/p-1