1-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-[2-(4-pyrazol-1-ylphenyl)ethyl]urea

Systemtic Name: 1-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-[2-(4-pyrazol-1-ylphenyl)ethyl]urea Openeye Name: 1-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-[2-(4-pyrazol-1-ylphenyl)ethyl]urea CAS Name: 1-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-[2-[4-(1-pyrazolyl)phenyl]ethyl]urea IUPAC Name: 1-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-3-[2-(4-pyrazol-1-ylphenyl)ethyl]urea Traditional Name: 1-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-[2-(4-pyrazol-1-ylphenyl)ethyl]urea Formula: C23H26N6OS MolecularWeight: 434.55714

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)NCCC3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

CSCC[C@@H](C1=NC2=CC=CC=C2N1)NC(=O)NCCC3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C23H26N6OS/c1-31-16-12-21(22-26-19-5-2-3-6-20(19)27-22)28-23(30)24-14-11-17-7-9-18(10-8-17)29-15-4-13-25-29/h2-10,13,15,21H,11-12,14,16H2,1H3,(H,26,27)(H2,24,28,30)/t21-/m0/s1