2,5-dioxo-3-(sodiooxysulfonyl)pyrrolidin-1-yl 6-[3-(pyridin-2-yldisulfanyl)propanamido]hexanoate

CAS: 169751-10-4

Formula: C18H22N3NaO8S3

SMILES: [Na]OS(=O)(=O)C1CC(=O)N(OC(=O)CCCCCNC(=O)CCSSC2=CC=CC=N2)C1=O

IUPAC: 2,5-dioxo-3-[(sodiooxy)sulfonyl]pyrrolidin-1-yl 6-[3-(pyridin-2-yldisulfanyl)propanamido]hexanoate

InChI: InChI=1/C18H23N3O8S3.Na/c22-14(8-11-30-31-15-6-3-5-10-20-15)19-9-4-1-2-7-17(24)29-21-16(23)12-13(18(21)25)32(26,27)28;/h3,5-6,10,13H,1-2,4,7-9,11-12H2,(H,19,22)(H,26,27,28);/q;+1/p-1

Composition: C (40.98%), H (4.20%), N (7.97%), Na (4.36%), O (24.26%), S (18.23%)

Molar Mass: 527.56

Atom Count: 55

Heavy Atom Count: 33