4-[5-[[6-[(4-aminophenyl)methylamino]-9-propan-2-yl-purin-2-yl]amino]pentanoyl]-1,3-thiazolidin-2-one

Systemtic Name: 4-[5-[[6-[(4-aminophenyl)methylamino]-9-propan-2-yl-purin-2-yl]amino]pentanoyl]-1,3-thiazolidin-2-one Openeye Name: 4-[5-[[6-[(4-aminophenyl)methylamino]-9-isopropyl-purin-2-yl]amino]pentanoyl]thiazolidin-2-one CAS Name: 4-[5-[[6-[(4-aminophenyl)methylamino]-9-propan-2-yl-2-purinyl]amino]-1-oxopentyl]-2-thiazolidinone IUPAC Name: 4-[5-[[6-[(4-aminophenyl)methylamino]-9-propan-2-ylpurin-2-yl]amino]pentanoyl]-1,3-thiazolidin-2-one Traditional Name: 4-[5-[[6-[(4-aminobenzyl)amino]-9-isopropyl-purin-2-yl]amino]pentanoyl]thiazolidin-2-one Formula: C23H30N8O2S MolecularWeight: 482.6017

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)N)NCCCCC(=O)C4CSC(=O)N4

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)N)NCCCCC(=O)C4CSC(=O)N4

InChI

InChI=1S/C23H30N8O2S/c1-14(2)31-13-27-19-20(26-11-15-6-8-16(24)9-7-15)29-22(30-21(19)31)25-10-4-3-5-18(32)17-12-34-23(33)28-17/h6-9,13-14,17H,3-5,10-12,24H2,1-2H3,(H,28,33)(H2,25,26,29,30)