5-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-[[5-(phenylsulfonyl)thiophen-2-yl]sulfonylamino]pentanoic acid

Systemtic Name: 5-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-[[5-(phenylsulfonyl)thiophen-2-yl]sulfonylamino]pentanoic acid Openeye Name: 2-[[5-(benzenesulfonyl)-2-thienyl]sulfonylamino]-5-(1,3-dioxoisoindolin-2-yl)pentanoic acid CAS Name: 2-[[5-(benzenesulfonyl)-2-thiophenyl]sulfonylamino]-5-(1,3-dioxo-2-isoindolyl)pentanoic acid IUPAC Name: 2-[[5-(benzenesulfonyl)thiophen-2-yl]sulfonylamino]-5-(1,3-dioxoisoindol-2-yl)pentanoic acid Traditional Name: 2-[(5-besyl-2-thienyl)sulfonylamino]-5-phthalimido-valeric acid Formula: C23H20N2O8S3 MolecularWeight: 548.6085

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(S2)S(=O)(=O)NC(CCCN3C(=O)C4=CC=CC=C4C3=O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(S2)S(=O)(=O)NC(CCCN3C(=O)C4=CC=CC=C4C3=O)C(=O)O

InChI

InChI=1S/C23H20N2O8S3/c26-21-16-9-4-5-10-17(16)22(27)25(21)14-6-11-18(23(28)29)24-36(32,33)20-13-12-19(34-20)35(30,31)15-7-2-1-3-8-15/h1-5,7-10,12-13,18,24H,6,11,14H2,(H,28,29)