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

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-phenylsulfanyl-propanamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-phenylsulfanyl-propanamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-(phenylthio)propanamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-2-phenylsulfanylpropanamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-(phenylthio)propionamide Formula: C20H23N3OS2 MolecularWeight: 385.54612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CCSC)C1=NC2=CC=CC=C2N1)SC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)N[C@@H](CCSC)C1=NC2=CC=CC=C2N1)SC3=CC=CC=C3

InChI

InChI=1S/C20H23N3OS2/c1-14(26-15-8-4-3-5-9-15)20(24)23-18(12-13-25-2)19-21-16-10-6-7-11-17(16)22-19/h3-11,14,18H,12-13H2,1-2H3,(H,21,22)(H,23,24)/t14?,18-/m0/s1