4,5-dimethoxy-2-nitro-N-[2-(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)-5-thiophen-2-yl-pyrazol-3-yl]benzamide

Systemtic Name: 4,5-dimethoxy-2-nitro-N-[2-(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)-5-thiophen-2-yl-pyrazol-3-yl]benzamide Openeye Name: 4,5-dimethoxy-2-nitro-N-[2-(4-oxo-6-propyl-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]benzamide CAS Name: 4,5-dimethoxy-2-nitro-N-[2-(4-oxo-6-propyl-1H-pyrimidin-2-yl)-5-thiophen-2-yl-3-pyrazolyl]benzamide IUPAC Name: 4,5-dimethoxy-2-nitro-N-[2-(4-oxo-6-propyl-1H-pyrimidin-2-yl)-5-thiophen-2-ylpyrazol-3-yl]benzamide Traditional Name: N-[2-(4-keto-6-propyl-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]-4,5-dimethoxy-2-nitro-benzamide Formula: C23H22N6O6S MolecularWeight: 510.52238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22N6O6S/c1-4-6-13-9-21(30)26-23(24-13)28-20(11-15(27-28)19-7-5-8-36-19)25-22(31)14-10-17(34-2)18(35-3)12-16(14)29(32)33/h5,7-12H,4,6H2,1-3H3,(H,25,31)(H,24,26,30)