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

Systemtic Name: 2-ethyl-N-[2-[6-methyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]-5-thiophen-2-yl-pyrazol-3-yl]butanamide Openeye Name: N-[2-(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]-2-ethyl-butanamide CAS Name: 2-ethyl-N-[2-[6-methyl-4-oxo-5-(phenylmethyl)-1H-pyrimidin-2-yl]-5-thiophen-2-yl-3-pyrazolyl]butanamide IUPAC Name: N-[2-(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-thiophen-2-ylpyrazol-3-yl]-2-ethylbutanamide Traditional Name: N-[2-(5-benzyl-4-keto-6-methyl-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]-2-ethyl-butyramide Formula: C25H27N5O2S MolecularWeight: 461.57918

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27N5O2S/c1-4-18(5-2)23(31)27-22-15-20(21-12-9-13-33-21)29-30(22)25-26-16(3)19(24(32)28-25)14-17-10-7-6-8-11-17/h6-13,15,18H,4-5,14H2,1-3H3,(H,27,31)(H,26,28,32)