N-[3-[2-[2,4-bis(fluoranyl)phenyl]ethyl]-2,4-bis(oxidanylidene)-1H-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]-2,4-bis(oxidanylidene)-1H-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]-2,4-dioxo-1H-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]-2,4-dioxo-1H-quinazolin-7-yl]-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]-2,4-dioxo-1H-quinazolin-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]-2,4-diketo-1H-quinazolin-7-yl]-3,5-dimethyl-N'-(2,6,6-trimethylnorpinan-3-yl)piperazine-1-carboxamidine Formula: C33H42F2N6O2 MolecularWeight: 592.722386

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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(=O)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(=O)N5)CCC6=C(C=C(C=C6)F)F

InChI

InChI=1S/C33H42F2N6O2/c1-18-16-40(17-19(2)36-18)31(38-28-13-22-12-26(20(28)3)33(22,4)5)37-24-8-9-25-29(15-24)39-32(43)41(30(25)42)11-10-21-6-7-23(34)14-27(21)35/h6-9,14-15,18-20,22,26,28,36H,10-13,16-17H2,1-5H3,(H,37,38)(H,39,43)