ethyl 4-[2-[[(2R)-butan-2-yl]amino]-2-oxidanylidene-ethyl]sulfanyl-2-(furan-2-yl)-6-methyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[2-[[(2R)-butan-2-yl]amino]-2-oxidanylidene-ethyl]sulfanyl-2-(furan-2-yl)-6-methyl-pyrimidine-5-carboxylate Openeye Name: ethyl 2-(2-furyl)-4-methyl-6-[2-[[(1R)-1-methylpropyl]amino]-2-oxo-ethyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 4-[[2-[[(2R)-butan-2-yl]amino]-2-oxoethyl]thio]-2-(2-furanyl)-6-methyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[[(2R)-butan-2-yl]amino]-2-oxoethyl]sulfanyl-2-(furan-2-yl)-6-methylpyrimidine-5-carboxylate Traditional Name: 2-(2-furyl)-4-[[2-keto-2-[[(1R)-1-methylpropyl]amino]ethyl]thio]-6-methyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H23N3O4S MolecularWeight: 377.45792

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CSC1=NC(=NC(=C1C(=O)OCC)C)C2=CC=CO2

Isomeric SMILES

CC[C@@H](C)NC(=O)CSC1=NC(=NC(=C1C(=O)OCC)C)C2=CC=CO2

InChI

InChI=1S/C18H23N3O4S/c1-5-11(3)19-14(22)10-26-17-15(18(23)24-6-2)12(4)20-16(21-17)13-8-7-9-25-13/h7-9,11H,5-6,10H2,1-4H3,(H,19,22)/t11-/m1/s1