ethyl 4-azanyl-2-[(2R)-1-(tert-butylcarbamoylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[(2R)-1-(tert-butylcarbamoylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[(1R)-2-(tert-butylcarbamoylamino)-1-methyl-2-oxo-ethyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[(2R)-1-[[(tert-butylamino)-oxomethyl]amino]-1-oxopropan-2-yl]thio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[(2R)-1-(tert-butylcarbamoylamino)-1-oxopropan-2-yl]sulfanylpyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[(1R)-2-(tert-butylcarbamoylamino)-2-keto-1-methyl-ethyl]thio]pyrimidine-5-carboxylic acid ethyl ester Formula: C15H23N5O4S MolecularWeight: 369.43922

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1N)SC(C)C(=O)NC(=O)NC(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N)S[C@H](C)C(=O)NC(=O)NC(C)(C)C

InChI

InChI=1S/C15H23N5O4S/c1-6-24-12(22)9-7-17-14(18-10(9)16)25-8(2)11(21)19-13(23)20-15(3,4)5/h7-8H,6H2,1-5H3,(H2,16,17,18)(H2,19,20,21,23)/t8-/m1/s1