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

Systemtic Name: N-[4-[bis(azanyl)methylideneamino]sulfonylphenyl]-4-nitro-benzamide Openeye Name: N-(4-guanidinosulfonylphenyl)-4-nitro-benzamide CAS Name: N-[4-(diaminomethylideneamino)sulfonylphenyl]-4-nitrobenzamide IUPAC Name: N-[4-(diaminomethylideneamino)sulfonylphenyl]-4-nitrobenzamide Traditional Name: N-(4-guanidinosulfonylphenyl)-4-nitro-benzamide Formula: C14H13N5O5S MolecularWeight: 363.34852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=CC=C(C=C2)S(=O)(=O)N=C(N)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=CC=C(C=C2)S(=O)(=O)N=C(N)N)[N+](=O)[O-]

InChI

InChI=1S/C14H13N5O5S/c15-14(16)18-25(23,24)12-7-3-10(4-8-12)17-13(20)9-1-5-11(6-2-9)19(21)22/h1-8H,(H,17,20)(H4,15,16,18)