N-[2-(1,3-benzothiazol-2-yl)-4-bromanyl-phenyl]-4-chloranyl-3-nitro-benzamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)-4-bromanyl-phenyl]-4-chloranyl-3-nitro-benzamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)-4-bromo-phenyl]-4-chloro-3-nitro-benzamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)-4-bromophenyl]-4-chloro-3-nitrobenzamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)-4-bromophenyl]-4-chloro-3-nitrobenzamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)-4-bromo-phenyl]-4-chloro-3-nitro-benzamide Formula: C20H11BrClN3O3S MolecularWeight: 488.74164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=C(C=CC(=C3)Br)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=C(C=CC(=C3)Br)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H11BrClN3O3S/c21-12-6-8-15(13(10-12)20-24-16-3-1-2-4-18(16)29-20)23-19(26)11-5-7-14(22)17(9-11)25(27)28/h1-10H,(H,23,26)