N-[9,10-bis(oxidanylidene)anthracen-2-yl]-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[9,10-bis(oxidanylidene)anthracen-2-yl]-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanamide Openeye Name: N-(9,10-dioxo-2-anthryl)-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetamide CAS Name: N-(9,10-dioxo-2-anthracenyl)-2-[(6-nitro-1,3-benzothiazol-2-yl)thio]acetamide IUPAC Name: N-(9,10-dioxoanthracen-2-yl)-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetamide Traditional Name: N-(9,10-diketo-2-anthryl)-2-[(6-nitro-1,3-benzothiazol-2-yl)thio]acetamide Formula: C23H13N3O5S2 MolecularWeight: 475.49642

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)NC(=O)CSC4=NC5=C(S4)C=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)NC(=O)CSC4=NC5=C(S4)C=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H13N3O5S2/c27-20(11-32-23-25-18-8-6-13(26(30)31)10-19(18)33-23)24-12-5-7-16-17(9-12)22(29)15-4-2-1-3-14(15)21(16)28/h1-10H,11H2,(H,24,27)