4-[(3-bromanyl-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-N-(5-ethoxy-1,3,4-thiadiazol-2-yl)benzenesulfonamide

Systemtic Name: 4-[(3-bromanyl-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-N-(5-ethoxy-1,3,4-thiadiazol-2-yl)benzenesulfonamide Openeye Name: 4-[(3-bromo-5-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-N-(5-ethoxy-1,3,4-thiadiazol-2-yl)benzenesulfonamide CAS Name: 4-[(3-bromo-5-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-N-(5-ethoxy-1,3,4-thiadiazol-2-yl)benzenesulfonamide IUPAC Name: 4-[(3-bromo-5-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-N-(5-ethoxy-1,3,4-thiadiazol-2-yl)benzenesulfonamide Traditional Name: 4-[(3-bromo-6-keto-5-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]-N-(5-ethoxy-1,3,4-thiadiazol-2-yl)benzenesulfonamide Formula: C17H14BrN5O6S2 MolecularWeight: 528.35696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NN=C(S1)NS(=O)(=O)C2=CC=C(C=C2)NC=C3C=C(C=C(C3=O)[N+](=O)[O-])Br

Isomeric SMILES

CCOC1=NN=C(S1)NS(=O)(=O)C2=CC=C(C=C2)NC=C3C=C(C=C(C3=O)[N+](=O)[O-])Br

InChI

InChI=1S/C17H14BrN5O6S2/c1-2-29-17-21-20-16(30-17)22-31(27,28)13-5-3-12(4-6-13)19-9-10-7-11(18)8-14(15(10)24)23(25)26/h3-9,19H,2H2,1H3,(H,20,22)