tert-butyl N-[4-(2-cyclopropyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-5-yl)butyl]carbamate

Systemtic Name: tert-butyl N-[4-(2-cyclopropyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-5-yl)butyl]carbamate Openeye Name: tert-butyl N-[4-(2-cyclopropyl-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)butyl]carbamate CAS Name: N-[4-(2-cyclopropyl-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)butyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-(2-cyclopropyl-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)butyl]carbamate Traditional Name: N-[4-(2-cyclopropyl-4-hydroxy-6-keto-1H-pyrimidin-5-yl)butyl]carbamic acid tert-butyl ester Formula: C16H25N3O4 MolecularWeight: 323.3874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCCC1=C(N=C(NC1=O)C2CC2)O

Isomeric SMILES

CC(C)(C)OC(=O)NCCCCC1=C(N=C(NC1=O)C2CC2)O

InChI

InChI=1S/C16H25N3O4/c1-16(2,3)23-15(22)17-9-5-4-6-11-13(20)18-12(10-7-8-10)19-14(11)21/h10H,4-9H2,1-3H3,(H,17,22)(H2,18,19,20,21)