5-chloranyl-2-(5-nitropyridin-2-yl)sulfanyl-1,3-benzothiazole

Systemtic Name: 5-chloranyl-2-(5-nitropyridin-2-yl)sulfanyl-1,3-benzothiazole Openeye Name: 5-chloro-2-[(5-nitro-2-pyridyl)sulfanyl]-1,3-benzothiazole CAS Name: 5-chloro-2-[(5-nitro-2-pyridinyl)thio]-1,3-benzothiazole IUPAC Name: 5-chloro-2-(5-nitropyridin-2-yl)sulfanyl-1,3-benzothiazole Traditional Name: 5-chloro-2-[(5-nitro-2-pyridyl)thio]-1,3-benzothiazole Formula: C12H6ClN3O2S2 MolecularWeight: 323.77794

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)N=C(S2)SC3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1Cl)N=C(S2)SC3=NC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C12H6ClN3O2S2/c13-7-1-3-10-9(5-7)15-12(19-10)20-11-4-2-8(6-14-11)16(17)18/h1-6H