2-[(4,5-dimethyl-1,3-thiazol-2-yl)sulfanyl]-6-nitro-1,3-benzothiazole

Systemtic Name: 2-[(4,5-dimethyl-1,3-thiazol-2-yl)sulfanyl]-6-nitro-1,3-benzothiazole Openeye Name: 2-(4,5-dimethylthiazol-2-yl)sulfanyl-6-nitro-1,3-benzothiazole CAS Name: 2-[(4,5-dimethyl-2-thiazolyl)thio]-6-nitro-1,3-benzothiazole IUPAC Name: 2-[(4,5-dimethyl-1,3-thiazol-2-yl)sulfanyl]-6-nitro-1,3-benzothiazole Traditional Name: 2-[(4,5-dimethylthiazol-2-yl)thio]-6-nitro-1,3-benzothiazole Formula: C12H9N3O2S3 MolecularWeight: 323.41376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)SC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(SC(=N1)SC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C12H9N3O2S3/c1-6-7(2)18-11(13-6)20-12-14-9-4-3-8(15(16)17)5-10(9)19-12/h3-5H,1-2H3