propan-2-yl 3-[[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]carbamoylamino]propanoate

Systemtic Name: propan-2-yl 3-[[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]carbamoylamino]propanoate Openeye Name: isopropyl 3-[[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]carbamoylamino]propanoate CAS Name: 3-[[[[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]amino]-oxomethyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]carbamoylamino]propanoate Traditional Name: 3-[[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]carbamoylamino]propionic acid isopropyl ester Formula: C18H26N4O3S MolecularWeight: 378.48904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CCNC(=O)NC(CCSC)C1=NC2=CC=CC=C2N1

Isomeric SMILES

CC(C)OC(=O)CCNC(=O)N[C@@H](CCSC)C1=NC2=CC=CC=C2N1

InChI

InChI=1S/C18H26N4O3S/c1-12(2)25-16(23)8-10-19-18(24)22-15(9-11-26-3)17-20-13-6-4-5-7-14(13)21-17/h4-7,12,15H,8-11H2,1-3H3,(H,20,21)(H2,19,22,24)/t15-/m0/s1