4-nitro-N-[4-[6-[(4-nitrophenyl)carbonylamino]-1,3-benzothiazol-2-yl]phenyl]benzamide

Systemtic Name: 4-nitro-N-[4-[6-[(4-nitrophenyl)carbonylamino]-1,3-benzothiazol-2-yl]phenyl]benzamide Openeye Name: 4-nitro-N-[4-[6-[(4-nitrobenzoyl)amino]-1,3-benzothiazol-2-yl]phenyl]benzamide CAS Name: 4-nitro-N-[4-[6-[[(4-nitrophenyl)-oxomethyl]amino]-1,3-benzothiazol-2-yl]phenyl]benzamide IUPAC Name: 4-nitro-N-[4-[6-[(4-nitrobenzoyl)amino]-1,3-benzothiazol-2-yl]phenyl]benzamide Traditional Name: 4-nitro-N-[4-[6-[(4-nitrobenzoyl)amino]-1,3-benzothiazol-2-yl]phenyl]benzamide Formula: C27H17N5O6S MolecularWeight: 539.51878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-])NC(=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-])NC(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C27H17N5O6S/c33-25(16-3-10-21(11-4-16)31(35)36)28-19-7-1-18(2-8-19)27-30-23-14-9-20(15-24(23)39-27)29-26(34)17-5-12-22(13-6-17)32(37)38/h1-15H,(H,28,33)(H,29,34)