1-[2-[3-(3-fluoranyl-4-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethyl]pyrrolidine-2,5-dione

Systemtic Name: 1-[2-[3-(3-fluoranyl-4-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethyl]pyrrolidine-2,5-dione Openeye Name: 1-[2-[3-(3-fluoro-4-methyl-phenyl)-4-oxo-quinazolin-2-yl]sulfanylethyl]pyrrolidine-2,5-dione CAS Name: 1-[2-[[3-(3-fluoro-4-methylphenyl)-4-oxo-2-quinazolinyl]thio]ethyl]pyrrolidine-2,5-dione IUPAC Name: 1-[2-[3-(3-fluoro-4-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylethyl]pyrrolidine-2,5-dione Traditional Name: 1-[2-[[3-(3-fluoro-4-methyl-phenyl)-4-keto-quinazolin-2-yl]thio]ethyl]pyrrolidine-2,5-quinone Formula: C21H18FN3O3S MolecularWeight: 411.449323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCCN4C(=O)CCC4=O)F

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCCN4C(=O)CCC4=O)F

InChI

InChI=1S/C21H18FN3O3S/c1-13-6-7-14(12-16(13)22)25-20(28)15-4-2-3-5-17(15)23-21(25)29-11-10-24-18(26)8-9-19(24)27/h2-7,12H,8-11H2,1H3