2-[3-(1,3-benzoxazol-2-ylsulfanyl)-6-nitro-quinoxalin-2-yl]sulfanyl-1,3-benzoxazole

Systemtic Name: 2-[3-(1,3-benzoxazol-2-ylsulfanyl)-6-nitro-quinoxalin-2-yl]sulfanyl-1,3-benzoxazole Openeye Name: 2-[3-(1,3-benzoxazol-2-ylsulfanyl)-6-nitro-quinoxalin-2-yl]sulfanyl-1,3-benzoxazole CAS Name: 2-[[3-(1,3-benzoxazol-2-ylthio)-6-nitro-2-quinoxalinyl]thio]-1,3-benzoxazole IUPAC Name: 2-[3-(1,3-benzoxazol-2-ylsulfanyl)-6-nitroquinoxalin-2-yl]sulfanyl-1,3-benzoxazole Traditional Name: 2-[[3-(1,3-benzoxazol-2-ylthio)-6-nitro-quinoxalin-2-yl]thio]-1,3-benzoxazole Formula: C22H11N5O4S2 MolecularWeight: 473.48384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)SC3=NC4=C(C=C(C=C4)[N+](=O)[O-])N=C3SC5=NC6=CC=CC=C6O5

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)SC3=NC4=C(C=C(C=C4)[N+](=O)[O-])N=C3SC5=NC6=CC=CC=C6O5

InChI

InChI=1S/C22H11N5O4S2/c28-27(29)12-9-10-13-16(11-12)24-20(33-22-26-15-6-2-4-8-18(15)31-22)19(23-13)32-21-25-14-5-1-3-7-17(14)30-21/h1-11H