N-[5-[2-[1-[4-[[4-(methylamino)-1,1-bis(oxidanylidene)-1,2,5-thiadiazol-3-yl]amino]phenyl]propan-2-ylamino]-1-oxidanyl-ethyl]-2-oxidanyl-phenyl]methanesulfonamide

Systemtic Name: N-[5-[2-[1-[4-[[4-(methylamino)-1,1-bis(oxidanylidene)-1,2,5-thiadiazol-3-yl]amino]phenyl]propan-2-ylamino]-1-oxidanyl-ethyl]-2-oxidanyl-phenyl]methanesulfonamide Openeye Name: N-[2-hydroxy-5-[1-hydroxy-2-[[1-methyl-2-[4-[[4-(methylamino)-1,1-dioxo-1,2,5-thiadiazol-3-yl]amino]phenyl]ethyl]amino]ethyl]phenyl]methanesulfonamide CAS Name: N-[2-hydroxy-5-[1-hydroxy-2-[1-[4-[[4-(methylamino)-1,1-dioxo-1,2,5-thiadiazol-3-yl]amino]phenyl]propan-2-ylamino]ethyl]phenyl]methanesulfonamide IUPAC Name: N-[2-hydroxy-5-[1-hydroxy-2-[1-[4-[[4-(methylamino)-1,1-dioxo-1,2,5-thiadiazol-3-yl]amino]phenyl]propan-2-ylamino]ethyl]phenyl]methanesulfonamide Traditional Name: N-[5-[2-[[2-[4-[[1,1-diketo-4-(methylamino)-1,2,5-thiadiazol-3-yl]amino]phenyl]-1-methyl-ethyl]amino]-1-hydroxy-ethyl]-2-hydroxy-phenyl]methanesulfonamide Formula: C21H28N6O6S2 MolecularWeight: 524.61362

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)NC2=NS(=O)(=O)N=C2NC)NCC(C3=CC(=C(C=C3)O)NS(=O)(=O)C)O

Isomeric SMILES

CC(CC1=CC=C(C=C1)NC2=NS(=O)(=O)N=C2NC)NCC(C3=CC(=C(C=C3)O)NS(=O)(=O)C)O

InChI

InChI=1S/C21H28N6O6S2/c1-13(23-12-19(29)15-6-9-18(28)17(11-15)25-34(3,30)31)10-14-4-7-16(8-5-14)24-21-20(22-2)26-35(32,33)27-21/h4-9,11,13,19,23,25,28-29H,10,12H2,1-3H3,(H,22,26)(H,24,27)