2-[(4-nitropyrazol-1-yl)methylsulfanyl]-1,3-benzothiazole

Systemtic Name: 2-[(4-nitropyrazol-1-yl)methylsulfanyl]-1,3-benzothiazole Openeye Name: 2-[(4-nitropyrazol-1-yl)methylsulfanyl]-1,3-benzothiazole CAS Name: 2-[(4-nitro-1-pyrazolyl)methylthio]-1,3-benzothiazole IUPAC Name: 2-[(4-nitropyrazol-1-yl)methylsulfanyl]-1,3-benzothiazole Traditional Name: 2-[(4-nitropyrazol-1-yl)methylthio]-1,3-benzothiazole Formula: C11H8N4O2S2 MolecularWeight: 292.33682

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCN3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCN3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C11H8N4O2S2/c16-15(17)8-5-12-14(6-8)7-18-11-13-9-3-1-2-4-10(9)19-11/h1-6H,7H2