ethyl 4-azanyl-2-[2-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxidanylidene-ethoxy]-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[2-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxidanylidene-ethoxy]-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[2-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxo-ethoxy]-2-oxo-ethyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[2-[2-(2,5-dimethyl-1-propyl-3-pyrrolyl)-2-oxoethoxy]-2-oxoethyl]thio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[2-[2-(2,5-dimethyl-1-propylpyrrol-3-yl)-2-oxoethoxy]-2-oxoethyl]sulfanylpyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[2-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-keto-ethoxy]-2-keto-ethyl]thio]pyrimidine-5-carboxylic acid ethyl ester Formula: C20H26N4O5S MolecularWeight: 434.50924

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C(=O)COC(=O)CSC2=NC=C(C(=N2)N)C(=O)OCC)C

Isomeric SMILES

CCCN1C(=CC(=C1C)C(=O)COC(=O)CSC2=NC=C(C(=N2)N)C(=O)OCC)C

InChI

InChI=1S/C20H26N4O5S/c1-5-7-24-12(3)8-14(13(24)4)16(25)10-29-17(26)11-30-20-22-9-15(18(21)23-20)19(27)28-6-2/h8-9H,5-7,10-11H2,1-4H3,(H2,21,22,23)