N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-(3-chloranylphenoxy)propanamide

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-(3-chloranylphenoxy)propanamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-(3-chlorophenoxy)propanamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-(3-chlorophenoxy)propanamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-2-(3-chlorophenoxy)propanamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-(3-chlorophenoxy)propionamide Formula: C20H22ClN3O2S MolecularWeight: 403.92558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CCSC)C1=NC2=CC=CC=C2N1)OC3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C(=O)NC(CCSC)C1=NC2=CC=CC=C2N1)OC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H22ClN3O2S/c1-13(26-15-7-5-6-14(21)12-15)20(25)24-18(10-11-27-2)19-22-16-8-3-4-9-17(16)23-19/h3-9,12-13,18H,10-11H2,1-2H3,(H,22,23)(H,24,25)