3-[(2R,4S,5R)-2-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-5-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl]-1-methyl-1-nitroso-urea

Systemtic Name: 3-[(2R,4S,5R)-2-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-5-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl]-1-methyl-1-nitroso-urea Openeye Name: 3-[(2R,4S,5R)-2-(2-amino-6-oxo-3H-purin-9-yl)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-3-yl]-1-methyl-1-nitroso-urea CAS Name: 3-[(2R,4S,5R)-2-(2-amino-6-oxo-3H-purin-9-yl)-4-hydroxy-5-(hydroxymethyl)-3-oxolanyl]-1-methyl-1-nitrosourea IUPAC Name: 3-[(2R,4S,5R)-2-(2-amino-6-oxo-3H-purin-9-yl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl]-1-methyl-1-nitrosourea Traditional Name: 3-[(2R,4S,5R)-2-(2-amino-6-keto-3H-purin-9-yl)-4-hydroxy-5-methylol-tetrahydrofuran-3-yl]-1-methyl-1-nitroso-urea Formula: C12H16N8O6 MolecularWeight: 368.30544

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)NC1C(C(OC1N2C=NC3=C2NC(=NC3=O)N)CO)O)N=O

Isomeric SMILES

CN(C(=O)NC1[C@@H]([C@H](O[C@H]1N2C=NC3=C2NC(=NC3=O)N)CO)O)N=O

InChI

InChI=1S/C12H16N8O6/c1-19(18-25)12(24)15-5-7(22)4(2-21)26-10(5)20-3-14-6-8(20)16-11(13)17-9(6)23/h3-5,7,10,21-22H,2H2,1H3,(H,15,24)(H3,13,16,17,23)/t4-,5?,7-,10-/m1/s1