N-(4-bromanyl-1,3-benzothiazol-2-yl)-5-nitro-thiophene-2-carboxamide

Systemtic Name: N-(4-bromanyl-1,3-benzothiazol-2-yl)-5-nitro-thiophene-2-carboxamide Openeye Name: N-(4-bromo-1,3-benzothiazol-2-yl)-5-nitro-thiophene-2-carboxamide CAS Name: N-(4-bromo-1,3-benzothiazol-2-yl)-5-nitro-2-thiophenecarboxamide IUPAC Name: N-(4-bromo-1,3-benzothiazol-2-yl)-5-nitrothiophene-2-carboxamide Traditional Name: N-(4-bromo-1,3-benzothiazol-2-yl)-5-nitro-thiophene-2-carboxamide Formula: C12H6BrN3O3S2 MolecularWeight: 384.22834

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)Br)N=C(S2)NC(=O)C3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C(=C1)Br)N=C(S2)NC(=O)C3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C12H6BrN3O3S2/c13-6-2-1-3-7-10(6)14-12(21-7)15-11(17)8-4-5-9(20-8)16(18)19/h1-5H,(H,14,15,17)