2-[(5-bromanyl-2-methyl-1,3-thiazol-4-yl)methylsulfanyl]-5-nitro-1,3-benzoxazole

Systemtic Name: 2-[(5-bromanyl-2-methyl-1,3-thiazol-4-yl)methylsulfanyl]-5-nitro-1,3-benzoxazole Openeye Name: 2-[(5-bromo-2-methyl-thiazol-4-yl)methylsulfanyl]-5-nitro-1,3-benzoxazole CAS Name: 2-[(5-bromo-2-methyl-4-thiazolyl)methylthio]-5-nitro-1,3-benzoxazole IUPAC Name: 2-[(5-bromo-2-methyl-1,3-thiazol-4-yl)methylsulfanyl]-5-nitro-1,3-benzoxazole Traditional Name: 2-[(5-bromo-2-methyl-thiazol-4-yl)methylthio]-5-nitro-1,3-benzoxazole Formula: C12H8BrN3O3S2 MolecularWeight: 386.24422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(S1)Br)CSC2=NC3=C(O2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=C(S1)Br)CSC2=NC3=C(O2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C12H8BrN3O3S2/c1-6-14-9(11(13)21-6)5-20-12-15-8-4-7(16(17)18)2-3-10(8)19-12/h2-4H,5H2,1H3