3-[5-chloranyl-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-N-(2-nitrophenyl)propanamide

Systemtic Name: 3-[5-chloranyl-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-N-(2-nitrophenyl)propanamide Openeye Name: 3-[5-chloro-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-N-(2-nitrophenyl)propanamide CAS Name: 3-[[5-chloro-1-(2-methoxyethyl)-2-benzimidazolyl]thio]-N-(2-nitrophenyl)propanamide IUPAC Name: 3-[5-chloro-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-N-(2-nitrophenyl)propanamide Traditional Name: 3-[[5-chloro-1-(2-methoxyethyl)benzimidazol-2-yl]thio]-N-(2-nitrophenyl)propionamide Formula: C19H19ClN4O4S MolecularWeight: 434.89656

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=C(C=C(C=C2)Cl)N=C1SCCC(=O)NC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

COCCN1C2=C(C=C(C=C2)Cl)N=C1SCCC(=O)NC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H19ClN4O4S/c1-28-10-9-23-16-7-6-13(20)12-15(16)22-19(23)29-11-8-18(25)21-14-4-2-3-5-17(14)24(26)27/h2-7,12H,8-11H2,1H3,(H,21,25)