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

Systemtic Name: N-[5-[1-[1-[4-[[4-(methylamino)-1,1-bis(oxidanylidene)-1,2,5-thiadiazol-3-yl]amino]phenyl]propan-2-ylamino]propan-2-yl]-2-phenylmethoxy-phenyl]methanesulfonamide Openeye Name: N-[2-benzyloxy-5-[1-methyl-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-[5-[1-[1-[4-[[4-(methylamino)-1,1-dioxo-1,2,5-thiadiazol-3-yl]amino]phenyl]propan-2-ylamino]propan-2-yl]-2-phenylmethoxyphenyl]methanesulfonamide IUPAC Name: N-[5-[1-[1-[4-[[4-(methylamino)-1,1-dioxo-1,2,5-thiadiazol-3-yl]amino]phenyl]propan-2-ylamino]propan-2-yl]-2-phenylmethoxyphenyl]methanesulfonamide Traditional Name: N-[2-benzoxy-5-[2-[[2-[4-[[1,1-diketo-4-(methylamino)-1,2,5-thiadiazol-3-yl]amino]phenyl]-1-methyl-ethyl]amino]-1-methyl-ethyl]phenyl]methanesulfonamide Formula: C29H36N6O5S2 MolecularWeight: 612.76334

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)NC2=NS(=O)(=O)N=C2NC)NCC(C)C3=CC(=C(C=C3)OCC4=CC=CC=C4)NS(=O)(=O)C

Isomeric SMILES

CC(CC1=CC=C(C=C1)NC2=NS(=O)(=O)N=C2NC)NCC(C)C3=CC(=C(C=C3)OCC4=CC=CC=C4)NS(=O)(=O)C

InChI

InChI=1S/C29H36N6O5S2/c1-20(24-12-15-27(26(17-24)33-41(4,36)37)40-19-23-8-6-5-7-9-23)18-31-21(2)16-22-10-13-25(14-11-22)32-29-28(30-3)34-42(38,39)35-29/h5-15,17,20-21,31,33H,16,18-19H2,1-4H3,(H,30,34)(H,32,35)