ethyl 4-ethanoyl-5-methyl-2-[2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanylbutanoylamino]furan-3-carboxylate

Systemtic Name: ethyl 4-ethanoyl-5-methyl-2-[2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanylbutanoylamino]furan-3-carboxylate Openeye Name: ethyl 4-acetyl-5-methyl-2-[2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanylbutanoylamino]furan-3-carboxylate CAS Name: 4-acetyl-5-methyl-2-[[2-[(2-methyl-6-phenyl-4-pyrimidinyl)thio]-1-oxobutyl]amino]-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 4-acetyl-5-methyl-2-[2-(2-methyl-6-phenylpyrimidin-4-yl)sulfanylbutanoylamino]furan-3-carboxylate Traditional Name: 4-acetyl-5-methyl-2-[2-[(2-methyl-6-phenyl-pyrimidin-4-yl)thio]butanoylamino]furan-3-carboxylic acid ethyl ester Formula: C25H27N3O5S MolecularWeight: 481.56398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C(=C(O1)C)C(=O)C)C(=O)OCC)SC2=NC(=NC(=C2)C3=CC=CC=C3)C

Isomeric SMILES

CCC(C(=O)NC1=C(C(=C(O1)C)C(=O)C)C(=O)OCC)SC2=NC(=NC(=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C25H27N3O5S/c1-6-19(34-20-13-18(26-16(5)27-20)17-11-9-8-10-12-17)23(30)28-24-22(25(31)32-7-2)21(14(3)29)15(4)33-24/h8-13,19H,6-7H2,1-5H3,(H,28,30)