1-[3-[2-(2-fluoranyl-4-methoxy-phenyl)ethyl]-4-oxidanylidene-quinazolin-7-yl]-3-(4,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl)thiourea

Systemtic Name: 1-[3-[2-(2-fluoranyl-4-methoxy-phenyl)ethyl]-4-oxidanylidene-quinazolin-7-yl]-3-(4,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl)thiourea Openeye Name: 1-[3-[2-(2-fluoro-4-methoxy-phenyl)ethyl]-4-oxo-quinazolin-7-yl]-3-(2,6,6-trimethylnorpinan-3-yl)thiourea CAS Name: 1-[3-[2-(2-fluoro-4-methoxyphenyl)ethyl]-4-oxo-7-quinazolinyl]-3-(4,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl)thiourea IUPAC Name: 1-[3-[2-(2-fluoro-4-methoxyphenyl)ethyl]-4-oxoquinazolin-7-yl]-3-(4,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl)thiourea Traditional Name: 1-[3-[2-(2-fluoro-4-methoxy-phenyl)ethyl]-4-keto-quinazolin-7-yl]-3-(2,6,6-trimethylnorpinan-3-yl)thiourea Formula: C28H33FN4O2S MolecularWeight: 508.650623

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2CC(C2(C)C)CC1NC(=S)NC3=CC4=C(C=C3)C(=O)N(C=N4)CCC5=C(C=C(C=C5)OC)F

Isomeric SMILES

CC1C2CC(C2(C)C)CC1NC(=S)NC3=CC4=C(C=C3)C(=O)N(C=N4)CCC5=C(C=C(C=C5)OC)F

InChI

InChI=1S/C28H33FN4O2S/c1-16-22-11-18(28(22,2)3)12-24(16)32-27(36)31-19-6-8-21-25(13-19)30-15-33(26(21)34)10-9-17-5-7-20(35-4)14-23(17)29/h5-8,13-16,18,22,24H,9-12H2,1-4H3,(H2,31,32,36)