4-[[6-[4-(cyclopentylamino)phenyl]sulfonyloxy-1H-benzimidazol-2-yl]carbamoylamino]butanoic acid

Systemtic Name: 4-[[6-[4-(cyclopentylamino)phenyl]sulfonyloxy-1H-benzimidazol-2-yl]carbamoylamino]butanoic acid Openeye Name: 4-[[6-[4-(cyclopentylamino)phenyl]sulfonyloxy-1H-benzimidazol-2-yl]carbamoylamino]butanoic acid CAS Name: 4-[[[[6-[4-(cyclopentylamino)phenyl]sulfonyloxy-1H-benzimidazol-2-yl]amino]-oxomethyl]amino]butanoic acid IUPAC Name: 4-[[6-[4-(cyclopentylamino)phenyl]sulfonyloxy-1H-benzimidazol-2-yl]carbamoylamino]butanoic acid Traditional Name: 4-[[6-[4-(cyclopentylamino)phenyl]sulfonyloxy-1H-benzimidazol-2-yl]carbamoylamino]butyric acid Formula: C23H27N5O6S MolecularWeight: 501.55538

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC2=CC=C(C=C2)S(=O)(=O)OC3=CC4=C(C=C3)N=C(N4)NC(=O)NCCCC(=O)O

Isomeric SMILES

C1CCC(C1)NC2=CC=C(C=C2)S(=O)(=O)OC3=CC4=C(C=C3)N=C(N4)NC(=O)NCCCC(=O)O

InChI

InChI=1S/C23H27N5O6S/c29-21(30)6-3-13-24-23(31)28-22-26-19-12-9-17(14-20(19)27-22)34-35(32,33)18-10-7-16(8-11-18)25-15-4-1-2-5-15/h7-12,14-15,25H,1-6,13H2,(H,29,30)(H3,24,26,27,28,31)