3,4-bis(1,3-benzoxazol-2-ylsulfanyl)-1-(2-nitrophenyl)pyrrole-2,5-dione

Systemtic Name: 3,4-bis(1,3-benzoxazol-2-ylsulfanyl)-1-(2-nitrophenyl)pyrrole-2,5-dione Openeye Name: 3,4-bis(1,3-benzoxazol-2-ylsulfanyl)-1-(2-nitrophenyl)pyrrole-2,5-dione CAS Name: 3,4-bis(1,3-benzoxazol-2-ylthio)-1-(2-nitrophenyl)pyrrole-2,5-dione IUPAC Name: 3,4-bis(1,3-benzoxazol-2-ylsulfanyl)-1-(2-nitrophenyl)pyrrole-2,5-dione Traditional Name: 3,4-bis(1,3-benzoxazol-2-ylthio)-1-(2-nitrophenyl)-3-pyrroline-2,5-quinone Formula: C24H12N4O6S2 MolecularWeight: 516.50528

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)SC3=C(C(=O)N(C3=O)C4=CC=CC=C4[N+](=O)[O-])SC5=NC6=CC=CC=C6O5

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)SC3=C(C(=O)N(C3=O)C4=CC=CC=C4[N+](=O)[O-])SC5=NC6=CC=CC=C6O5

InChI

InChI=1S/C24H12N4O6S2/c29-21-19(35-23-25-13-7-1-5-11-17(13)33-23)20(36-24-26-14-8-2-6-12-18(14)34-24)22(30)27(21)15-9-3-4-10-16(15)28(31)32/h1-12H