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

Systemtic Name: 2-[[6-[4-(cyclopentylamino)phenyl]sulfonyloxy-1H-benzimidazol-2-yl]carbamoylamino]ethanoic acid Openeye Name: 2-[[6-[4-(cyclopentylamino)phenyl]sulfonyloxy-1H-benzimidazol-2-yl]carbamoylamino]acetic acid CAS Name: 2-[[[[6-[4-(cyclopentylamino)phenyl]sulfonyloxy-1H-benzimidazol-2-yl]amino]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[6-[4-(cyclopentylamino)phenyl]sulfonyloxy-1H-benzimidazol-2-yl]carbamoylamino]acetic acid Traditional Name: 2-[[6-[4-(cyclopentylamino)phenyl]sulfonyloxy-1H-benzimidazol-2-yl]carbamoylamino]acetic acid Formula: C21H23N5O6S MolecularWeight: 473.50222

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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)NCC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C21H23N5O6S/c27-19(28)12-22-21(29)26-20-24-17-10-7-15(11-18(17)25-20)32-33(30,31)16-8-5-14(6-9-16)23-13-3-1-2-4-13/h5-11,13,23H,1-4,12H2,(H,27,28)(H3,22,24,25,26,29)