tert-butyl (2S)-2-azanyl-4-(3-azanyl-4-cyano-1H-pyrazol-5-yl)pentanoate

Systemtic Name: tert-butyl (2S)-2-azanyl-4-(3-azanyl-4-cyano-1H-pyrazol-5-yl)pentanoate Openeye Name: tert-butyl (2S)-2-amino-4-(3-amino-4-cyano-1H-pyrazol-5-yl)pentanoate CAS Name: (2S)-2-amino-4-(3-amino-4-cyano-1H-pyrazol-5-yl)pentanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-amino-4-(3-amino-4-cyano-1H-pyrazol-5-yl)pentanoate Traditional Name: (2S)-2-amino-4-(3-amino-4-cyano-1H-pyrazol-5-yl)valeric acid tert-butyl ester Formula: C13H21N5O2 MolecularWeight: 279.33814

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C(=O)OC(C)(C)C)N)C1=C(C(=NN1)N)C#N

Isomeric SMILES

CC(C[C@@H](C(=O)OC(C)(C)C)N)C1=C(C(=NN1)N)C#N

InChI

InChI=1S/C13H21N5O2/c1-7(10-8(6-14)11(16)18-17-10)5-9(15)12(19)20-13(2,3)4/h7,9H,5,15H2,1-4H3,(H3,16,17,18)/t7?,9-/m0/s1