1-[4,4-bis(fluoranyl)cyclohexyl]-3-[3-[2-(2-fluoranyl-4-methoxy-phenyl)ethyl]-4-oxidanylidene-quinazolin-7-yl]thiourea

Systemtic Name: 1-[4,4-bis(fluoranyl)cyclohexyl]-3-[3-[2-(2-fluoranyl-4-methoxy-phenyl)ethyl]-4-oxidanylidene-quinazolin-7-yl]thiourea Openeye Name: 1-(4,4-difluorocyclohexyl)-3-[3-[2-(2-fluoro-4-methoxy-phenyl)ethyl]-4-oxo-quinazolin-7-yl]thiourea CAS Name: 1-(4,4-difluorocyclohexyl)-3-[3-[2-(2-fluoro-4-methoxyphenyl)ethyl]-4-oxo-7-quinazolinyl]thiourea IUPAC Name: 1-(4,4-difluorocyclohexyl)-3-[3-[2-(2-fluoro-4-methoxyphenyl)ethyl]-4-oxoquinazolin-7-yl]thiourea Traditional Name: 1-(4,4-difluorocyclohexyl)-3-[3-[2-(2-fluoro-4-methoxy-phenyl)ethyl]-4-keto-quinazolin-7-yl]thiourea Formula: C24H25F3N4O2S MolecularWeight: 490.54111

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CCN2C=NC3=C(C2=O)C=CC(=C3)NC(=S)NC4CCC(CC4)(F)F)F

Isomeric SMILES

COC1=CC(=C(C=C1)CCN2C=NC3=C(C2=O)C=CC(=C3)NC(=S)NC4CCC(CC4)(F)F)F

InChI

InChI=1S/C24H25F3N4O2S/c1-33-18-4-2-15(20(25)13-18)8-11-31-14-28-21-12-17(3-5-19(21)22(31)32)30-23(34)29-16-6-9-24(26,27)10-7-16/h2-5,12-14,16H,6-11H2,1H3,(H2,29,30,34)