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

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(4-fluoranylphenoxy)propanamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(4-fluorophenoxy)propanamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-(4-fluorophenoxy)propanamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-3-(4-fluorophenoxy)propanamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-(4-fluorophenoxy)propionamide Formula: C20H22FN3O2S MolecularWeight: 387.470983

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)CCOC3=CC=C(C=C3)F

Isomeric SMILES

CSCC[C@@H](C1=NC2=CC=CC=C2N1)NC(=O)CCOC3=CC=C(C=C3)F

InChI

InChI=1S/C20H22FN3O2S/c1-27-13-11-18(20-23-16-4-2-3-5-17(16)24-20)22-19(25)10-12-26-15-8-6-14(21)7-9-15/h2-9,18H,10-13H2,1H3,(H,22,25)(H,23,24)/t18-/m0/s1