N-[2-(1,3-benzothiazol-2-yl)-5-nitro-phenyl]-4-chloranyl-benzamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)-5-nitro-phenyl]-4-chloranyl-benzamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)-5-nitro-phenyl]-4-chloro-benzamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)-5-nitrophenyl]-4-chlorobenzamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)-5-nitrophenyl]-4-chlorobenzamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)-5-nitro-phenyl]-4-chloro-benzamide Formula: C20H12ClN3O3S MolecularWeight: 409.84558

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H12ClN3O3S/c21-13-7-5-12(6-8-13)19(25)22-17-11-14(24(26)27)9-10-15(17)20-23-16-3-1-2-4-18(16)28-20/h1-11H,(H,22,25)