(2S)-2-[[5,6-bis(fluoranyl)-1H-benzimidazol-2-yl]sulfanyl]-N-phenethyl-propanamide

Systemtic Name: (2S)-2-[[5,6-bis(fluoranyl)-1H-benzimidazol-2-yl]sulfanyl]-N-phenethyl-propanamide Openeye Name: (2S)-2-[(5,6-difluoro-1H-benzimidazol-2-yl)sulfanyl]-N-phenethyl-propanamide CAS Name: (2S)-2-[(5,6-difluoro-1H-benzimidazol-2-yl)thio]-N-phenethylpropanamide IUPAC Name: (2S)-2-[(5,6-difluoro-1H-benzimidazol-2-yl)sulfanyl]-N-phenethylpropanamide Traditional Name: (2S)-2-[(5,6-difluoro-1H-benzimidazol-2-yl)thio]-N-phenethyl-propionamide Formula: C18H17F2N3OS MolecularWeight: 361.408886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC=CC=C1)SC2=NC3=CC(=C(C=C3N2)F)F

Isomeric SMILES

C[C@@H](C(=O)NCCC1=CC=CC=C1)SC2=NC3=CC(=C(C=C3N2)F)F

InChI

InChI=1S/C18H17F2N3OS/c1-11(17(24)21-8-7-12-5-3-2-4-6-12)25-18-22-15-9-13(19)14(20)10-16(15)23-18/h2-6,9-11H,7-8H2,1H3,(H,21,24)(H,22,23)/t11-/m0/s1