2-(4-nitrophenyl)-N-[2-(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)-5-thiophen-2-yl-pyrazol-3-yl]ethanamide

Systemtic Name: 2-(4-nitrophenyl)-N-[2-(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)-5-thiophen-2-yl-pyrazol-3-yl]ethanamide Openeye Name: 2-(4-nitrophenyl)-N-[2-(4-oxo-6-propyl-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]acetamide CAS Name: 2-(4-nitrophenyl)-N-[2-(4-oxo-6-propyl-1H-pyrimidin-2-yl)-5-thiophen-2-yl-3-pyrazolyl]acetamide IUPAC Name: 2-(4-nitrophenyl)-N-[2-(4-oxo-6-propyl-1H-pyrimidin-2-yl)-5-thiophen-2-ylpyrazol-3-yl]acetamide Traditional Name: N-[2-(4-keto-6-propyl-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]-2-(4-nitrophenyl)acetamide Formula: C22H20N6O4S MolecularWeight: 464.497

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CS3)NC(=O)CC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CS3)NC(=O)CC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H20N6O4S/c1-2-4-15-12-21(30)25-22(23-15)27-19(13-17(26-27)18-5-3-10-33-18)24-20(29)11-14-6-8-16(9-7-14)28(31)32/h3,5-10,12-13H,2,4,11H2,1H3,(H,24,29)(H,23,25,30)