N-[3-[2-[2,4-bis(fluoranyl)phenyl]ethyl]-4-oxidanylidene-quinazolin-7-yl]-3,5-dimethyl-N'-(4,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl)piperazine-1-carboximidamide

Systemtic Name: N-[3-[2-[2,4-bis(fluoranyl)phenyl]ethyl]-4-oxidanylidene-quinazolin-7-yl]-3,5-dimethyl-N'-(4,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl)piperazine-1-carboximidamide Openeye Name: N-[3-[2-(2,4-difluorophenyl)ethyl]-4-oxo-quinazolin-7-yl]-3,5-dimethyl-N'-(2,6,6-trimethylnorpinan-3-yl)piperazine-1-carboxamidine CAS Name: N-[3-[2-(2,4-difluorophenyl)ethyl]-4-oxo-7-quinazolinyl]-3,5-dimethyl-N'-(4,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl)-1-piperazinecarboximidamide IUPAC Name: N-[3-[2-(2,4-difluorophenyl)ethyl]-4-oxoquinazolin-7-yl]-3,5-dimethyl-N'-(4,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl)piperazine-1-carboximidamide Traditional Name: N-[3-[2-(2,4-difluorophenyl)ethyl]-4-keto-quinazolin-7-yl]-3,5-dimethyl-N'-(2,6,6-trimethylnorpinan-3-yl)piperazine-1-carboxamidine Formula: C33H42F2N6O MolecularWeight: 576.722986

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1)C)C(=NC2CC3CC(C2C)C3(C)C)NC4=CC5=C(C=C4)C(=O)N(C=N5)CCC6=C(C=C(C=C6)F)F

Isomeric SMILES

CC1CN(CC(N1)C)C(=NC2CC3CC(C2C)C3(C)C)NC4=CC5=C(C=C4)C(=O)N(C=N5)CCC6=C(C=C(C=C6)F)F

InChI

InChI=1S/C33H42F2N6O/c1-19-16-41(17-20(2)37-19)32(39-29-13-23-12-27(21(29)3)33(23,4)5)38-25-8-9-26-30(15-25)36-18-40(31(26)42)11-10-22-6-7-24(34)14-28(22)35/h6-9,14-15,18-21,23,27,29,37H,10-13,16-17H2,1-5H3,(H,38,39)