N-[2-(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)-5-thiophen-2-yl-pyrazol-3-yl]-9H-xanthene-9-carboxamide

Systemtic Name: N-[2-(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)-5-thiophen-2-yl-pyrazol-3-yl]-9H-xanthene-9-carboxamide Openeye Name: N-[2-(4-oxo-6-propyl-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]-9H-xanthene-9-carboxamide CAS Name: N-[2-(4-oxo-6-propyl-1H-pyrimidin-2-yl)-5-thiophen-2-yl-3-pyrazolyl]-9H-xanthene-9-carboxamide IUPAC Name: N-[2-(4-oxo-6-propyl-1H-pyrimidin-2-yl)-5-thiophen-2-ylpyrazol-3-yl]-9H-xanthene-9-carboxamide Traditional Name: N-[2-(4-keto-6-propyl-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]-9H-xanthene-9-carboxamide Formula: C28H23N5O3S MolecularWeight: 509.57892

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CS3)NC(=O)C4C5=CC=CC=C5OC6=CC=CC=C46

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CS3)NC(=O)C4C5=CC=CC=C5OC6=CC=CC=C46

InChI

InChI=1S/C28H23N5O3S/c1-2-8-17-15-25(34)31-28(29-17)33-24(16-20(32-33)23-13-7-14-37-23)30-27(35)26-18-9-3-5-11-21(18)36-22-12-6-4-10-19(22)26/h3-7,9-16,26H,2,8H2,1H3,(H,30,35)(H,29,31,34)