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

Systemtic Name: N-[2-(5-ethyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)-5-thiophen-2-yl-pyrazol-3-yl]butanamide Openeye Name: N-[2-(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]butanamide CAS Name: N-[2-(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-thiophen-2-yl-3-pyrazolyl]butanamide IUPAC Name: N-[2-(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-thiophen-2-ylpyrazol-3-yl]butanamide Traditional Name: N-[2-(5-ethyl-4-keto-6-methyl-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]butyramide Formula: C18H21N5O2S MolecularWeight: 371.45664

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=NN1C2=NC(=O)C(=C(N2)C)CC)C3=CC=CS3

Isomeric SMILES

CCCC(=O)NC1=CC(=NN1C2=NC(=O)C(=C(N2)C)CC)C3=CC=CS3

InChI

InChI=1S/C18H21N5O2S/c1-4-7-16(24)20-15-10-13(14-8-6-9-26-14)22-23(15)18-19-11(3)12(5-2)17(25)21-18/h6,8-10H,4-5,7H2,1-3H3,(H,20,24)(H,19,21,25)