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

Systemtic Name: 3-chloranyl-N-[2-(5-ethyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)-5-thiophen-2-yl-pyrazol-3-yl]propanamide Openeye Name: 3-chloro-N-[2-(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]propanamide CAS Name: 3-chloro-N-[2-(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-thiophen-2-yl-3-pyrazolyl]propanamide IUPAC Name: 3-chloro-N-[2-(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-thiophen-2-ylpyrazol-3-yl]propanamide Traditional Name: 3-chloro-N-[2-(5-ethyl-4-keto-6-methyl-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]propionamide Formula: C17H18ClN5O2S MolecularWeight: 391.87512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=NC1=O)N2C(=CC(=N2)C3=CC=CS3)NC(=O)CCCl)C

Isomeric SMILES

CCC1=C(NC(=NC1=O)N2C(=CC(=N2)C3=CC=CS3)NC(=O)CCCl)C

InChI

InChI=1S/C17H18ClN5O2S/c1-3-11-10(2)19-17(21-16(11)25)23-14(20-15(24)6-7-18)9-12(22-23)13-5-4-8-26-13/h4-5,8-9H,3,6-7H2,1-2H3,(H,20,24)(H,19,21,25)