N-[[4-[bis(azanyl)methylideneamino]sulfonylphenyl]carbamothioyl]-4-bromanyl-benzamide

Systemtic Name: N-[[4-[bis(azanyl)methylideneamino]sulfonylphenyl]carbamothioyl]-4-bromanyl-benzamide Openeye Name: 4-bromo-N-[(4-guanidinosulfonylphenyl)carbamothioyl]benzamide CAS Name: 4-bromo-N-[[4-(diaminomethylideneamino)sulfonylanilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-bromo-N-[[4-(diaminomethylideneamino)sulfonylphenyl]carbamothioyl]benzamide Traditional Name: 4-bromo-N-[(4-guanidinosulfonylphenyl)thiocarbamoyl]benzamide Formula: C15H14BrN5O3S2 MolecularWeight: 456.33736

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N=C(N)N)Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N=C(N)N)Br

InChI

InChI=1S/C15H14BrN5O3S2/c16-10-3-1-9(2-4-10)13(22)20-15(25)19-11-5-7-12(8-6-11)26(23,24)21-14(17)18/h1-8H,(H4,17,18,21)(H2,19,20,22,25)