2-(aminocarbonylamino)-6-[5-(6-aminopurin-9-yl)-3-oxidanyl-oxolan-2-yl]-5-azanyl-hexanamide

Systemtic Name: 2-(aminocarbonylamino)-6-[5-(6-aminopurin-9-yl)-3-oxidanyl-oxolan-2-yl]-5-azanyl-hexanamide Openeye Name: 5-amino-6-[5-(6-aminopurin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]-2-ureido-hexanamide CAS Name: 5-amino-6-[5-(6-aminopurin-9-yl)-3-hydroxy-2-oxolanyl]-2-(carbamoylamino)hexanamide IUPAC Name: 5-amino-6-[5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]-2-(carbamoylamino)hexanamide Traditional Name: 6-(5-adenin-9-yl-3-hydroxy-tetrahydrofuran-2-yl)-5-amino-2-ureido-hexanamide Formula: C16H25N9O4 MolecularWeight: 407.4276

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=NC3=C2N=CN=C3N)CC(CCC(C(=O)N)NC(=O)N)N)O

Isomeric SMILES

C1C(C(OC1N2C=NC3=C2N=CN=C3N)CC(CCC(C(=O)N)NC(=O)N)N)O

InChI

InChI=1S/C16H25N9O4/c17-7(1-2-8(14(19)27)24-16(20)28)3-10-9(26)4-11(29-10)25-6-23-12-13(18)21-5-22-15(12)25/h5-11,26H,1-4,17H2,(H2,19,27)(H2,18,21,22)(H3,20,24,28)