4-bromanyl-N-[4-oxidanylidene-3-(1H-1,2,4-triazol-5-ylsulfanyl)naphthalen-1-ylidene]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[4-oxidanylidene-3-(1H-1,2,4-triazol-5-ylsulfanyl)naphthalen-1-ylidene]benzenesulfonamide Openeye Name: 4-bromo-N-[4-oxo-3-(1H-1,2,4-triazol-5-ylsulfanyl)-1-naphthylidene]benzenesulfonamide CAS Name: 4-bromo-N-[4-oxo-3-(1H-1,2,4-triazol-5-ylthio)-1-naphthalenylidene]benzenesulfonamide IUPAC Name: 4-bromo-N-[4-oxo-3-(1H-1,2,4-triazol-5-ylsulfanyl)naphthalen-1-ylidene]benzenesulfonamide Traditional Name: 4-bromo-N-[4-keto-3-(1H-1,2,4-triazol-5-ylthio)-1-naphthylidene]benzenesulfonamide Formula: C18H11BrN4O3S2 MolecularWeight: 475.33894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NS(=O)(=O)C3=CC=C(C=C3)Br)C=C(C2=O)SC4=NC=NN4

Isomeric SMILES

C1=CC=C2C(=C1)C(=NS(=O)(=O)C3=CC=C(C=C3)Br)C=C(C2=O)SC4=NC=NN4

InChI

InChI=1S/C18H11BrN4O3S2/c19-11-5-7-12(8-6-11)28(25,26)23-15-9-16(27-18-20-10-21-22-18)17(24)14-4-2-1-3-13(14)15/h1-10H,(H,20,21,22)