5-[4-[[6-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]oxy-6-oxidanylidene-hexyl]carbamoyl]-2-oxidanylidene-3,3a,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoic acid

Systemtic Name: 5-[4-[[6-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]oxy-6-oxidanylidene-hexyl]carbamoyl]-2-oxidanylidene-3,3a,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoic acid Openeye Name: 5-[4-[[6-(2,5-dioxopyrrolidin-1-yl)oxy-6-oxo-hexyl]carbamoyl]-2-oxo-3,3a,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoic acid CAS Name: 5-[4-[[[6-[(2,5-dioxo-1-pyrrolidinyl)oxy]-6-oxohexyl]amino]-oxomethyl]-2-oxo-3,3a,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoic acid IUPAC Name: 5-[4-[[6-(2,5-dioxopyrrolidin-1-yl)oxy-6-oxohexyl]carbamoyl]-2-oxo-3,3a,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoic acid Traditional Name: 5-[2-keto-4-[(6-keto-6-succinimidooxy-hexyl)carbamoyl]-3,3a,6,6a-tetrahydro-1H-thien[3,4-d]imidazol-4-yl]valeric acid Formula: C21H30N4O8S MolecularWeight: 498.5499

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1=O)OC(=O)CCCCCNC(=O)C2(C3C(CS2)NC(=O)N3)CCCCC(=O)O

Isomeric SMILES

C1CC(=O)N(C1=O)OC(=O)CCCCCNC(=O)C2(C3C(CS2)NC(=O)N3)CCCCC(=O)O

InChI

InChI=1S/C21H30N4O8S/c26-14-8-9-15(27)25(14)33-17(30)7-2-1-5-11-22-19(31)21(10-4-3-6-16(28)29)18-13(12-34-21)23-20(32)24-18/h13,18H,1-12H2,(H,22,31)(H,28,29)(H2,23,24,32)