2-(4-bromanylnaphthalen-1-yl)sulfonyl-N-(1H-1,2,4-triazol-5-yl)ethanimidate

Systemtic Name: 2-(4-bromanylnaphthalen-1-yl)sulfonyl-N-(1H-1,2,4-triazol-5-yl)ethanimidate Openeye Name: 2-[(4-bromo-1-naphthyl)sulfonyl]-N-(1H-1,2,4-triazol-5-yl)ethanimidate CAS Name: 2-[(4-bromo-1-naphthalenyl)sulfonyl]-N-(1H-1,2,4-triazol-5-yl)ethanimidate IUPAC Name: 2-(4-bromonaphthalen-1-yl)sulfonyl-N-(1H-1,2,4-triazol-5-yl)ethanimidate Traditional Name: 2-[(4-bromo-1-naphthyl)sulfonyl]-N-(1H-1,2,4-triazol-5-yl)acetimidate Formula: C14H10BrN4O3S- MolecularWeight: 394.2232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=C2Br)S(=O)(=O)CC(=NC3=NC=NN3)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=C2Br)S(=O)(=O)CC(=NC3=NC=NN3)[O-]

InChI

InChI=1S/C14H11BrN4O3S/c15-11-5-6-12(10-4-2-1-3-9(10)11)23(21,22)7-13(20)18-14-16-8-17-19-14/h1-6,8H,7H2,(H2,16,17,18,19,20)/p-1