2-[5-(1,3-benzothiazol-2-ylsulfanyl)-2,4-dinitro-phenyl]sulfanyl-1,3-benzothiazole

Systemtic Name: 2-[5-(1,3-benzothiazol-2-ylsulfanyl)-2,4-dinitro-phenyl]sulfanyl-1,3-benzothiazole Openeye Name: 2-[5-(1,3-benzothiazol-2-ylsulfanyl)-2,4-dinitro-phenyl]sulfanyl-1,3-benzothiazole CAS Name: 2-[[5-(1,3-benzothiazol-2-ylthio)-2,4-dinitrophenyl]thio]-1,3-benzothiazole IUPAC Name: 2-[5-(1,3-benzothiazol-2-ylsulfanyl)-2,4-dinitrophenyl]sulfanyl-1,3-benzothiazole Traditional Name: 2-[[5-(1,3-benzothiazol-2-ylthio)-2,4-dinitro-phenyl]thio]-1,3-benzothiazole Formula: C20H10N4O4S4 MolecularWeight: 498.5778

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SC3=CC(=C(C=C3[N+](=O)[O-])[N+](=O)[O-])SC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SC3=CC(=C(C=C3[N+](=O)[O-])[N+](=O)[O-])SC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C20H10N4O4S4/c25-23(26)13-9-14(24(27)28)18(32-20-22-12-6-2-4-8-16(12)30-20)10-17(13)31-19-21-11-5-1-3-7-15(11)29-19/h1-10H