3-cyclopentyl-2-[2-(3-fluoranyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-cyclopentyl-2-[2-(3-fluoranyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one Openeye Name: 3-cyclopentyl-2-[2-(3-fluoro-4-methoxy-phenyl)-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-cyclopentyl-2-[[2-(3-fluoro-4-methoxyphenyl)-2-oxoethyl]thio]-4-quinazolinone IUPAC Name: 3-cyclopentyl-2-[2-(3-fluoro-4-methoxyphenyl)-2-oxoethyl]sulfanylquinazolin-4-one Traditional Name: 3-cyclopentyl-2-[[2-(3-fluoro-4-methoxy-phenyl)-2-keto-ethyl]thio]quinazolin-4-one Formula: C22H21FN2O3S MolecularWeight: 412.477143

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCC4)F

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCC4)F

InChI

InChI=1S/C22H21FN2O3S/c1-28-20-11-10-14(12-17(20)23)19(26)13-29-22-24-18-9-5-4-8-16(18)21(27)25(22)15-6-2-3-7-15/h4-5,8-12,15H,2-3,6-7,13H2,1H3