N-(2-fluoranyl-4-methyl-phenyl)-2-(3-methyl-4-oxidanylidene-benzo[g]quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-fluoranyl-4-methyl-phenyl)-2-(3-methyl-4-oxidanylidene-benzo[g]quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-fluoro-4-methyl-phenyl)-2-(3-methyl-4-oxo-benzo[g]quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(2-fluoro-4-methylphenyl)-2-[(3-methyl-4-oxo-2-benzo[g]quinazolinyl)thio]acetamide IUPAC Name: N-(2-fluoro-4-methylphenyl)-2-(3-methyl-4-oxobenzo[g]quinazolin-2-yl)sulfanylacetamide Traditional Name: N-(2-fluoro-4-methyl-phenyl)-2-[(4-keto-3-methyl-benzo[g]quinazolin-2-yl)thio]acetamide Formula: C22H18FN3O2S MolecularWeight: 407.460623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSC2=NC3=CC4=CC=CC=C4C=C3C(=O)N2C)F

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSC2=NC3=CC4=CC=CC=C4C=C3C(=O)N2C)F

InChI

InChI=1S/C22H18FN3O2S/c1-13-7-8-18(17(23)9-13)24-20(27)12-29-22-25-19-11-15-6-4-3-5-14(15)10-16(19)21(28)26(22)2/h3-11H,12H2,1-2H3,(H,24,27)