4-chloranyl-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-3-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-3-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-3-nitro-benzenesulfonamide Formula: C10H9ClN4O4S3 MolecularWeight: 380.85086

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCSC1=NN=C(S1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C10H9ClN4O4S3/c1-2-20-10-13-12-9(21-10)14-22(18,19)6-3-4-7(11)8(5-6)15(16)17/h3-5H,2H2,1H3,(H,12,14)