2-[3-(3-fluoranyl-4-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(1-thiophen-2-ylethyl)ethanamide

Systemtic Name: 2-[3-(3-fluoranyl-4-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(1-thiophen-2-ylethyl)ethanamide Openeye Name: 2-[3-(3-fluoro-4-methyl-phenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-[1-(2-thienyl)ethyl]acetamide CAS Name: 2-[[3-(3-fluoro-4-methylphenyl)-4-oxo-2-quinazolinyl]thio]-N-(1-thiophen-2-ylethyl)acetamide IUPAC Name: 2-[3-(3-fluoro-4-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(1-thiophen-2-ylethyl)acetamide Traditional Name: 2-[[3-(3-fluoro-4-methyl-phenyl)-4-keto-quinazolin-2-yl]thio]-N-[1-(2-thienyl)ethyl]acetamide Formula: C23H20FN3O2S2 MolecularWeight: 453.552203

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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(C)C4=CC=CS4)F

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC(C)C4=CC=CS4)F

InChI

InChI=1S/C23H20FN3O2S2/c1-14-9-10-16(12-18(14)24)27-22(29)17-6-3-4-7-19(17)26-23(27)31-13-21(28)25-15(2)20-8-5-11-30-20/h3-12,15H,13H2,1-2H3,(H,25,28)