phenylsulfonylamino 3-[[4-[4-(1H-benzimidazol-2-ylamino)piperidin-1-yl]phenyl]carbonylamino]propanoate

Systemtic Name: phenylsulfonylamino 3-[[4-[4-(1H-benzimidazol-2-ylamino)piperidin-1-yl]phenyl]carbonylamino]propanoate Openeye Name: benzenesulfonamido 3-[[4-[4-(1H-benzimidazol-2-ylamino)-1-piperidyl]benzoyl]amino]propanoate CAS Name: 3-[[[4-[4-(1H-benzimidazol-2-ylamino)-1-piperidinyl]phenyl]-oxomethyl]amino]propanoic acid benzenesulfonamido ester IUPAC Name: benzenesulfonamido 3-[[4-[4-(1H-benzimidazol-2-ylamino)piperidin-1-yl]benzoyl]amino]propanoate Traditional Name: 3-[[4-[4-(1H-benzimidazol-2-ylamino)piperidino]benzoyl]amino]propionic acid benzenesulfonamido ester Formula: C28H30N6O5S MolecularWeight: 562.64

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC2=NC3=CC=CC=C3N2)C4=CC=C(C=C4)C(=O)NCCC(=O)ONS(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1NC2=NC3=CC=CC=C3N2)C4=CC=C(C=C4)C(=O)NCCC(=O)ONS(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H30N6O5S/c35-26(39-33-40(37,38)23-6-2-1-3-7-23)14-17-29-27(36)20-10-12-22(13-11-20)34-18-15-21(16-19-34)30-28-31-24-8-4-5-9-25(24)32-28/h1-13,21,33H,14-19H2,(H,29,36)(H2,30,31,32)