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

Systemtic Name: 3-cyclopentyl-N-[2-(6-ethyl-4-oxidanylidene-1H-pyrimidin-2-yl)-5-thiophen-2-yl-pyrazol-3-yl]propanamide Openeye Name: 3-cyclopentyl-N-[2-(6-ethyl-4-oxo-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]propanamide CAS Name: 3-cyclopentyl-N-[2-(6-ethyl-4-oxo-1H-pyrimidin-2-yl)-5-thiophen-2-yl-3-pyrazolyl]propanamide IUPAC Name: 3-cyclopentyl-N-[2-(6-ethyl-4-oxo-1H-pyrimidin-2-yl)-5-thiophen-2-ylpyrazol-3-yl]propanamide Traditional Name: 3-cyclopentyl-N-[2-(6-ethyl-4-keto-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]propionamide Formula: C21H25N5O2S MolecularWeight: 411.5205

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CS3)NC(=O)CCC4CCCC4

Isomeric SMILES

CCC1=CC(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CS3)NC(=O)CCC4CCCC4

InChI

InChI=1S/C21H25N5O2S/c1-2-15-12-20(28)24-21(22-15)26-18(13-16(25-26)17-8-5-11-29-17)23-19(27)10-9-14-6-3-4-7-14/h5,8,11-14H,2-4,6-7,9-10H2,1H3,(H,23,27)(H,22,24,28)