N-(6-bromanyl-1,3-benzothiazol-2-yl)-2-(3-nitro-1,2,4-triazol-1-yl)ethanamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-2-(3-nitro-1,2,4-triazol-1-yl)ethanamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-(3-nitro-1,2,4-triazol-1-yl)acetamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-(3-nitro-1,2,4-triazol-1-yl)acetamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-(3-nitro-1,2,4-triazol-1-yl)acetamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-(3-nitro-1,2,4-triazol-1-yl)acetamide Formula: C11H7BrN6O3S MolecularWeight: 383.18068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)SC(=N2)NC(=O)CN3C=NC(=N3)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1Br)SC(=N2)NC(=O)CN3C=NC(=N3)[N+](=O)[O-]

InChI

InChI=1S/C11H7BrN6O3S/c12-6-1-2-7-8(3-6)22-11(14-7)15-9(19)4-17-5-13-10(16-17)18(20)21/h1-3,5H,4H2,(H,14,15,19)