5-[[4-[2-[(8-azanyl-7H-purin-6-yl)-methyl-amino]ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione

Systemtic Name: 5-[[4-[2-[(8-azanyl-7H-purin-6-yl)-methyl-amino]ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione Openeye Name: 5-[[4-[2-[(8-amino-7H-purin-6-yl)-methyl-amino]ethoxy]phenyl]methyl]thiazolidine-2,4-dione CAS Name: 5-[[4-[2-[(8-amino-7H-purin-6-yl)-methylamino]ethoxy]phenyl]methyl]thiazolidine-2,4-dione IUPAC Name: 5-[[4-[2-[(8-amino-7H-purin-6-yl)-methylamino]ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione Traditional Name: 5-[4-[2-[(8-amino-7H-purin-6-yl)-methyl-amino]ethoxy]benzyl]thiazolidine-2,4-quinone Formula: C18H19N7O3S MolecularWeight: 413.45356

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC=C(C=C1)CC2C(=O)NC(=O)S2)C3=NC=NC4=C3NC(=N4)N

Isomeric SMILES

CN(CCOC1=CC=C(C=C1)CC2C(=O)NC(=O)S2)C3=NC=NC4=C3NC(=N4)N

InChI

InChI=1S/C18H19N7O3S/c1-25(15-13-14(20-9-21-15)23-17(19)22-13)6-7-28-11-4-2-10(3-5-11)8-12-16(26)24-18(27)29-12/h2-5,9,12H,6-8H2,1H3,(H,24,26,27)(H3,19,20,21,22,23)