2-[[6-[4-(cyclopentylamino)phenyl]sulfonyloxy-1H-benzimidazol-2-yl]carbamoylamino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[[6-[4-(cyclopentylamino)phenyl]sulfonyloxy-1H-benzimidazol-2-yl]carbamoylamino]-3-oxidanyl-propanoic acid Openeye Name: 2-[[6-[4-(cyclopentylamino)phenyl]sulfonyloxy-1H-benzimidazol-2-yl]carbamoylamino]-3-hydroxy-propanoic acid CAS Name: 2-[[[[6-[4-(cyclopentylamino)phenyl]sulfonyloxy-1H-benzimidazol-2-yl]amino]-oxomethyl]amino]-3-hydroxypropanoic acid IUPAC Name: 2-[[6-[4-(cyclopentylamino)phenyl]sulfonyloxy-1H-benzimidazol-2-yl]carbamoylamino]-3-hydroxypropanoic acid Traditional Name: 2-[[6-[4-(cyclopentylamino)phenyl]sulfonyloxy-1H-benzimidazol-2-yl]carbamoylamino]-3-hydroxy-propionic acid Formula: C22H25N5O7S MolecularWeight: 503.5282

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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)NC(CO)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C22H25N5O7S/c28-12-19(20(29)30)26-22(31)27-21-24-17-10-7-15(11-18(17)25-21)34-35(32,33)16-8-5-14(6-9-16)23-13-3-1-2-4-13/h5-11,13,19,23,28H,1-4,12H2,(H,29,30)(H3,24,25,26,27,31)