ethyl 4-azanyl-2-[2-[2-(2-methylpropanoyl)hydrazinyl]-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[2-[2-(2-methylpropanoyl)hydrazinyl]-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[2-[2-(2-methylpropanoyl)hydrazino]-2-oxo-ethyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[2-[(2-methyl-1-oxopropyl)hydrazo]-2-oxoethyl]thio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[2-[2-(2-methylpropanoyl)hydrazinyl]-2-oxoethyl]sulfanylpyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[2-(N'-isobutyrylhydrazino)-2-keto-ethyl]thio]pyrimidine-5-carboxylic acid ethyl ester Formula: C13H19N5O4S MolecularWeight: 341.38606

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1N)SCC(=O)NNC(=O)C(C)C

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N)SCC(=O)NNC(=O)C(C)C

InChI

InChI=1S/C13H19N5O4S/c1-4-22-12(21)8-5-15-13(16-10(8)14)23-6-9(19)17-18-11(20)7(2)3/h5,7H,4,6H2,1-3H3,(H,17,19)(H,18,20)(H2,14,15,16)