N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-[(3-methoxyphenyl)methoxy]ethanamide

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-[(3-methoxyphenyl)methoxy]ethanamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-[(3-methoxyphenyl)methoxy]acetamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-[(3-methoxyphenyl)methoxy]acetamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-2-[(3-methoxyphenyl)methoxy]acetamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-m-anisyloxy-acetamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)COCC(=O)NC(CCSC)C2=NC3=CC=CC=C3N2

Isomeric SMILES

COC1=CC=CC(=C1)COCC(=O)N[C@@H](CCSC)C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C21H25N3O3S/c1-26-16-7-5-6-15(12-16)13-27-14-20(25)22-19(10-11-28-2)21-23-17-8-3-4-9-18(17)24-21/h3-9,12,19H,10-11,13-14H2,1-2H3,(H,22,25)(H,23,24)/t19-/m0/s1