N-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)-9,10-bis(oxidanylidene)anthracene-1-sulfonamide

Systemtic Name: N-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)-9,10-bis(oxidanylidene)anthracene-1-sulfonamide Openeye Name: N-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)-9,10-dioxo-anthracene-1-sulfonamide CAS Name: N-[3-(methylthio)-1H-1,2,4-triazol-5-yl]-9,10-dioxo-1-anthracenesulfonamide IUPAC Name: N-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)-9,10-dioxoanthracene-1-sulfonamide Traditional Name: 9,10-diketo-N-[3-(methylthio)-1H-1,2,4-triazol-5-yl]anthracene-1-sulfonamide Formula: C17H12N4O4S2 MolecularWeight: 400.43158

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NNC(=N1)NS(=O)(=O)C2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CSC1=NNC(=N1)NS(=O)(=O)C2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C17H12N4O4S2/c1-26-17-18-16(19-20-17)21-27(24,25)12-8-4-7-11-13(12)15(23)10-6-3-2-5-9(10)14(11)22/h2-8H,1H3,(H2,18,19,20,21)