N-[2-[3-(3-fluoranyl-4-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]-1-methyl-pyrrole-2-carboxamide

Systemtic Name: N-[2-[3-(3-fluoranyl-4-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]-1-methyl-pyrrole-2-carboxamide Openeye Name: N-[2-[3-(3-fluoro-4-methyl-phenyl)-4-oxo-quinazolin-2-yl]sulfanylacetyl]-1-methyl-pyrrole-2-carboxamide CAS Name: N-[2-[[3-(3-fluoro-4-methylphenyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: N-[2-[3-(3-fluoro-4-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]-1-methylpyrrole-2-carboxamide Traditional Name: N-[2-[[3-(3-fluoro-4-methyl-phenyl)-4-keto-quinazolin-2-yl]thio]acetyl]-1-methyl-pyrrole-2-carboxamide Formula: C23H19FN4O3S MolecularWeight: 450.485363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC(=O)C4=CC=CN4C)F

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC(=O)C4=CC=CN4C)F

InChI

InChI=1S/C23H19FN4O3S/c1-14-9-10-15(12-17(14)24)28-22(31)16-6-3-4-7-18(16)25-23(28)32-13-20(29)26-21(30)19-8-5-11-27(19)2/h3-12H,13H2,1-2H3,(H,26,29,30)