N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-4-(2-ethoxyphenoxy)butanamide

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-4-(2-ethoxyphenoxy)butanamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-4-(2-ethoxyphenoxy)butanamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-4-(2-ethoxyphenoxy)butanamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-4-(2-ethoxyphenoxy)butanamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-4-(2-ethoxyphenoxy)butyramide Formula: C23H29N3O3S MolecularWeight: 427.55966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OCCCC(=O)NC(CCSC)C2=NC3=CC=CC=C3N2

Isomeric SMILES

CCOC1=CC=CC=C1OCCCC(=O)NC(CCSC)C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C23H29N3O3S/c1-3-28-20-11-6-7-12-21(20)29-15-8-13-22(27)24-19(14-16-30-2)23-25-17-9-4-5-10-18(17)26-23/h4-7,9-12,19H,3,8,13-16H2,1-2H3,(H,24,27)(H,25,26)