N-(6-bromanyl-1,3-benzothiazol-2-yl)-2-methyl-3-nitro-benzamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-2-methyl-3-nitro-benzamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-methyl-3-nitro-benzamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-methyl-3-nitrobenzamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-methyl-3-nitrobenzamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-methyl-3-nitro-benzamide Formula: C15H10BrN3O3S MolecularWeight: 392.2272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=NC3=C(S2)C=C(C=C3)Br

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=NC3=C(S2)C=C(C=C3)Br

InChI

InChI=1S/C15H10BrN3O3S/c1-8-10(3-2-4-12(8)19(21)22)14(20)18-15-17-11-6-5-9(16)7-13(11)23-15/h2-7H,1H3,(H,17,18,20)