[2,5-bis(oxidanylidene)pyrrolidin-1-yl] 12-[5-[(3aS,6aR)-2-oxidanylidene-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]dodecanoate

Systemtic Name: [2,5-bis(oxidanylidene)pyrrolidin-1-yl] 12-[5-[(3aS,6aR)-2-oxidanylidene-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]dodecanoate Openeye Name: (2,5-dioxopyrrolidin-1-yl) 12-[5-[(3aS,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]dodecanoate CAS Name: 12-[[5-[(3aS,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-1-oxopentyl]amino]dodecanoic acid (2,5-dioxo-1-pyrrolidinyl) ester IUPAC Name: (2,5-dioxopyrrolidin-1-yl) 12-[5-[(3aS,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]dodecanoate Traditional Name: 12-[5-[(3aS,6aR)-2-keto-1,3,3a,4,6,6a-hexahydrothien[3,4-d]imidazol-4-yl]pentanoylamino]lauric acid succinimido ester Formula: C26H42N4O6S MolecularWeight: 538.69988

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1=O)OC(=O)CCCCCCCCCCCNC(=O)CCCCC2C3C(CS2)NC(=O)N3

Isomeric SMILES

C1CC(=O)N(C1=O)OC(=O)CCCCCCCCCCCNC(=O)CCCCC2[C@@H]3[C@H](CS2)NC(=O)N3

InChI

InChI=1S/C26H42N4O6S/c31-21(13-10-9-12-20-25-19(18-37-20)28-26(35)29-25)27-17-11-7-5-3-1-2-4-6-8-14-24(34)36-30-22(32)15-16-23(30)33/h19-20,25H,1-18H2,(H,27,31)(H2,28,29,35)/t19-,20?,25-/m0/s1