N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-(4-methoxyphenoxy)propanamide

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-(4-methoxyphenoxy)propanamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-(4-methoxyphenoxy)propanamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-(4-methoxyphenoxy)propanamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-2-(4-methoxyphenoxy)propanamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-(4-methoxyphenoxy)propionamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O3S/c1-14(27-16-10-8-15(26-2)9-11-16)21(25)24-19(12-13-28-3)20-22-17-6-4-5-7-18(17)23-20/h4-11,14,19H,12-13H2,1-3H3,(H,22,23)(H,24,25)