1-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-pentan-2-yl-urea

Systemtic Name: 1-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-pentan-2-yl-urea Openeye Name: 1-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(1-methylbutyl)urea CAS Name: 1-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-pentan-2-ylurea IUPAC Name: 1-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-3-pentan-2-ylurea Traditional Name: 1-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-(1-methylbutyl)urea Formula: C17H26N4OS MolecularWeight: 334.47954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)NC(CCSC)C1=NC2=CC=CC=C2N1

Isomeric SMILES

CCCC(C)NC(=O)N[C@@H](CCSC)C1=NC2=CC=CC=C2N1

InChI

InChI=1S/C17H26N4OS/c1-4-7-12(2)18-17(22)21-15(10-11-23-3)16-19-13-8-5-6-9-14(13)20-16/h5-6,8-9,12,15H,4,7,10-11H2,1-3H3,(H,19,20)(H2,18,21,22)/t12?,15-/m0/s1