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

Systemtic Name: 3,4,5-triethoxy-N-[2-(4-oxidanylidene-6-propan-2-yl-1H-pyrimidin-2-yl)-5-thiophen-2-yl-pyrazol-3-yl]benzamide Openeye Name: 3,4,5-triethoxy-N-[2-(6-isopropyl-4-oxo-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]benzamide CAS Name: 3,4,5-triethoxy-N-[2-(4-oxo-6-propan-2-yl-1H-pyrimidin-2-yl)-5-thiophen-2-yl-3-pyrazolyl]benzamide IUPAC Name: 3,4,5-triethoxy-N-[2-(4-oxo-6-propan-2-yl-1H-pyrimidin-2-yl)-5-thiophen-2-ylpyrazol-3-yl]benzamide Traditional Name: 3,4,5-triethoxy-N-[2-(6-isopropyl-4-keto-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]benzamide Formula: C27H31N5O5S MolecularWeight: 537.63054

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=CC(=NN2C3=NC(=O)C=C(N3)C(C)C)C4=CC=CS4

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=CC(=NN2C3=NC(=O)C=C(N3)C(C)C)C4=CC=CS4

InChI

InChI=1S/C27H31N5O5S/c1-6-35-20-12-17(13-21(36-7-2)25(20)37-8-3)26(34)29-23-14-19(22-10-9-11-38-22)31-32(23)27-28-18(16(4)5)15-24(33)30-27/h9-16H,6-8H2,1-5H3,(H,29,34)(H,28,30,33)