2-[(6-chloranyl-1H-benzimidazol-2-yl)sulfanyl]-N-(2-cyano-4-nitro-phenyl)ethanamide

Systemtic Name: 2-[(6-chloranyl-1H-benzimidazol-2-yl)sulfanyl]-N-(2-cyano-4-nitro-phenyl)ethanamide Openeye Name: 2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]-N-(2-cyano-4-nitro-phenyl)acetamide CAS Name: 2-[(6-chloro-1H-benzimidazol-2-yl)thio]-N-(2-cyano-4-nitrophenyl)acetamide IUPAC Name: 2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]-N-(2-cyano-4-nitrophenyl)acetamide Traditional Name: 2-[(6-chloro-1H-benzimidazol-2-yl)thio]-N-(2-cyano-4-nitro-phenyl)acetamide Formula: C16H10ClN5O3S MolecularWeight: 387.8003

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])C#N)NC(=O)CSC2=NC3=C(N2)C=C(C=C3)Cl

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])C#N)NC(=O)CSC2=NC3=C(N2)C=C(C=C3)Cl

InChI

InChI=1S/C16H10ClN5O3S/c17-10-1-3-13-14(6-10)21-16(20-13)26-8-15(23)19-12-4-2-11(22(24)25)5-9(12)7-18/h1-6H,8H2,(H,19,23)(H,20,21)