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

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(3-methoxyphenyl)propanamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(3-methoxyphenyl)propanamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-(3-methoxyphenyl)propanamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-3-(3-methoxyphenyl)propanamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-(3-methoxyphenyl)propionamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O2S/c1-26-16-7-5-6-15(14-16)10-11-20(25)22-19(12-13-27-2)21-23-17-8-3-4-9-18(17)24-21/h3-9,14,19H,10-13H2,1-2H3,(H,22,25)(H,23,24)