N1,N2-bis(1,3-benzothiazol-2-yl)-4-nitro-benzene-1,2-dicarboxamide

Systemtic Name: N1,N2-bis(1,3-benzothiazol-2-yl)-4-nitro-benzene-1,2-dicarboxamide Openeye Name: N1,N2-bis(1,3-benzothiazol-2-yl)-4-nitro-phthalamide CAS Name: N1,N2-bis(1,3-benzothiazol-2-yl)-4-nitrobenzene-1,2-dicarboxamide IUPAC Name: 1-N,2-N-bis(1,3-benzothiazol-2-yl)-4-nitrobenzene-1,2-dicarboxamide Traditional Name: N,N'-bis(1,3-benzothiazol-2-yl)-4-nitro-phthalamide Formula: C22H13N5O4S2 MolecularWeight: 475.49972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)NC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)NC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H13N5O4S2/c28-19(25-21-23-15-5-1-3-7-17(15)32-21)13-10-9-12(27(30)31)11-14(13)20(29)26-22-24-16-6-2-4-8-18(16)33-22/h1-11H,(H,23,25,28)(H,24,26,29)