N-[(1R)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-4-(2-methylpropoxy)benzamide

Systemtic Name: N-[(1R)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-4-(2-methylpropoxy)benzamide Openeye Name: N-[(1R)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-4-isobutoxy-benzamide CAS Name: N-[(1R)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-4-(2-methylpropoxy)benzamide IUPAC Name: N-[(1R)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-4-(2-methylpropoxy)benzamide Traditional Name: N-[(1R)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-4-isobutoxy-benzamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O2S/c1-15(2)14-27-17-10-8-16(9-11-17)22(26)25-20(12-13-28-3)21-23-18-6-4-5-7-19(18)24-21/h4-11,15,20H,12-14H2,1-3H3,(H,23,24)(H,25,26)/t20-/m1/s1