2-[(6-chloranyl-1H-benzimidazol-2-yl)sulfanyl]-N-(3-nitrophenyl)propanamide

Systemtic Name: 2-[(6-chloranyl-1H-benzimidazol-2-yl)sulfanyl]-N-(3-nitrophenyl)propanamide Openeye Name: 2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]-N-(3-nitrophenyl)propanamide CAS Name: 2-[(6-chloro-1H-benzimidazol-2-yl)thio]-N-(3-nitrophenyl)propanamide IUPAC Name: 2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]-N-(3-nitrophenyl)propanamide Traditional Name: 2-[(6-chloro-1H-benzimidazol-2-yl)thio]-N-(3-nitrophenyl)propionamide Formula: C16H13ClN4O3S MolecularWeight: 376.81742

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])SC2=NC3=C(N2)C=C(C=C3)Cl

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])SC2=NC3=C(N2)C=C(C=C3)Cl

InChI

InChI=1S/C16H13ClN4O3S/c1-9(15(22)18-11-3-2-4-12(8-11)21(23)24)25-16-19-13-6-5-10(17)7-14(13)20-16/h2-9H,1H3,(H,18,22)(H,19,20)