4-azanyl-N-(4,5-dicyano-2-nitro-phenyl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide

Systemtic Name: 4-azanyl-N-(4,5-dicyano-2-nitro-phenyl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide Openeye Name: 4-amino-N-(4,5-dicyano-2-nitro-phenyl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide CAS Name: 4-amino-N-(4,5-dicyano-2-nitrophenyl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide IUPAC Name: 4-amino-N-(4,5-dicyano-2-nitrophenyl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide Traditional Name: 4-amino-N-(4,5-dicyano-2-nitro-phenyl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide Formula: C18H13N7O4S2 MolecularWeight: 455.47032

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)N(C2=C(C=C(C(=C2)C#N)C#N)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)N

Isomeric SMILES

CCC1=NN=C(S1)N(C2=C(C=C(C(=C2)C#N)C#N)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)N

InChI

InChI=1S/C18H13N7O4S2/c1-2-17-22-23-18(30-17)24(31(28,29)14-5-3-13(21)4-6-14)15-7-11(9-19)12(10-20)8-16(15)25(26)27/h3-8H,2,21H2,1H3