ethyl 4-[[2-[6-methyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]-5-thiophen-2-yl-pyrazol-3-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[[2-[6-methyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]-5-thiophen-2-yl-pyrazol-3-yl]amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[[2-(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]amino]-4-oxo-butanoate CAS Name: 4-[[2-[6-methyl-4-oxo-5-(phenylmethyl)-1H-pyrimidin-2-yl]-5-thiophen-2-yl-3-pyrazolyl]amino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-thiophen-2-ylpyrazol-3-yl]amino]-4-oxobutanoate Traditional Name: 4-[[2-(5-benzyl-4-keto-6-methyl-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]amino]-4-keto-butyric acid ethyl ester Formula: C25H25N5O4S MolecularWeight: 491.5621

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)NC1=CC(=NN1C2=NC(=O)C(=C(N2)C)CC3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

CCOC(=O)CCC(=O)NC1=CC(=NN1C2=NC(=O)C(=C(N2)C)CC3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C25H25N5O4S/c1-3-34-23(32)12-11-22(31)27-21-15-19(20-10-7-13-35-20)29-30(21)25-26-16(2)18(24(33)28-25)14-17-8-5-4-6-9-17/h4-10,13,15H,3,11-12,14H2,1-2H3,(H,27,31)(H,26,28,33)