2-[5-chloranyl-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-N-(4-ethanoylphenyl)propanamide

Systemtic Name: 2-[5-chloranyl-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-N-(4-ethanoylphenyl)propanamide Openeye Name: N-(4-acetylphenyl)-2-[5-chloro-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-propanamide CAS Name: N-(4-acetylphenyl)-2-[[5-chloro-1-(2-methoxyethyl)-2-benzimidazolyl]thio]propanamide IUPAC Name: N-(4-acetylphenyl)-2-[5-chloro-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylpropanamide Traditional Name: N-(4-acetylphenyl)-2-[[5-chloro-1-(2-methoxyethyl)benzimidazol-2-yl]thio]propionamide Formula: C21H22ClN3O3S MolecularWeight: 431.93568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(=O)C)SC2=NC3=C(N2CCOC)C=CC(=C3)Cl

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C(=O)C)SC2=NC3=C(N2CCOC)C=CC(=C3)Cl

InChI

InChI=1S/C21H22ClN3O3S/c1-13(26)15-4-7-17(8-5-15)23-20(27)14(2)29-21-24-18-12-16(22)6-9-19(18)25(21)10-11-28-3/h4-9,12,14H,10-11H2,1-3H3,(H,23,27)