tert-butyl N-[(2S,3S)-3-methyl-1-oxidanylidene-1-[2-(pyrimidin-4-ylcarbamoyl)pyrazolidin-1-yl]pentan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S,3S)-3-methyl-1-oxidanylidene-1-[2-(pyrimidin-4-ylcarbamoyl)pyrazolidin-1-yl]pentan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S,2S)-2-methyl-1-[2-(pyrimidin-4-ylcarbamoyl)pyrazolidine-1-carbonyl]butyl]carbamate CAS Name: N-[(2S,3S)-3-methyl-1-oxo-1-[2-[oxo-(4-pyrimidinylamino)methyl]-1-pyrazolidinyl]pentan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S,3S)-3-methyl-1-oxo-1-[2-(pyrimidin-4-ylcarbamoyl)pyrazolidin-1-yl]pentan-2-yl]carbamate Traditional Name: N-[(1S,2S)-2-methyl-1-[2-(4-pyrimidylcarbamoyl)pyrazolidine-1-carbonyl]butyl]carbamic acid tert-butyl ester Formula: C19H30N6O4 MolecularWeight: 406.4793

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCCN1C(=O)NC2=NC=NC=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)N1CCCN1C(=O)NC2=NC=NC=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C19H30N6O4/c1-6-13(2)15(23-18(28)29-19(3,4)5)16(26)24-10-7-11-25(24)17(27)22-14-8-9-20-12-21-14/h8-9,12-13,15H,6-7,10-11H2,1-5H3,(H,23,28)(H,20,21,22,27)/t13-,15-/m0/s1