N-[2-[(2-chloranyl-6-nitro-phenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]ethanamide

Systemtic Name: N-[2-[(2-chloranyl-6-nitro-phenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]ethanamide Openeye Name: N-[2-[(2-chloro-6-nitro-phenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]acetamide CAS Name: N-[2-[(2-chloro-6-nitrophenyl)methylthio]-1,3-benzothiazol-6-yl]acetamide IUPAC Name: N-[2-[(2-chloro-6-nitrophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]acetamide Traditional Name: N-[2-[(2-chloro-6-nitro-benzyl)thio]-1,3-benzothiazol-6-yl]acetamide Formula: C16H12ClN3O3S2 MolecularWeight: 393.86778

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N=C(S2)SCC3=C(C=CC=C3Cl)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N=C(S2)SCC3=C(C=CC=C3Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H12ClN3O3S2/c1-9(21)18-10-5-6-13-15(7-10)25-16(19-13)24-8-11-12(17)3-2-4-14(11)20(22)23/h2-7H,8H2,1H3,(H,18,21)