Analyte Name

(4S,6S)-4-(Ethylamino)-N-(((4R,6R)-4-(ethylamino)-6-methyl-7,7-dioxido-5,6-dihydro-4H-thieno[2,3-b]thiopyran-2-yl)sulfonyl)-6-methyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-2-sulfonamide 7,7-dioxide

Molecular Formula

C20H29N3O8S6

Molecular Weight

631.85

Accurate Mass

631.03

SMILES

O=S1([C@@H](C[C@H](C2=C1SC(S(NS(C3=CC4=C(S([C@H](C[C@@H]4NCC)C)(=O)=O)S3)(=O)=O)(=O)=O)=C2)NCC)C)=O

InChI

InChI=1S/C20H29N3O8S6/c1-5-21-15-7-11(3)34(24,25)19-13(15)9-17(32-19)36(28,29)23-37(30,31)18-10-14-16(22-6-2)8-12(4)35(26,27)20(14)33-18/h9-12,15-16,21-23H,5-8H2,1-4H3/t11-,12+,15-,16+

IUPAC

(4S,6S)-4-(ethylamino)-N-(((4R,6R)-4-(ethylamino)-6-methyl-7,7-dioxido-5,6-dihydro-4H-thieno[2,3-b]thiopyran-2-yl)sulfonyl)-6-methyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-2-sulfonamide 7,7-dioxide

Alternate CAS Number

199734-72-0

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat