N-[3-[2-(2-fluoranyl-4-methoxy-phenyl)ethyl]-4-oxidanylidene-quinazolin-7-yl]-4-methyl-N'-[(1S,4S,5R)-4,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl]-1,4-diazepane-1-carboximidamide

Systemtic Name: N-[3-[2-(2-fluoranyl-4-methoxy-phenyl)ethyl]-4-oxidanylidene-quinazolin-7-yl]-4-methyl-N'-[(1S,4S,5R)-4,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl]-1,4-diazepane-1-carboximidamide Openeye Name: N-[3-[2-(2-fluoro-4-methoxy-phenyl)ethyl]-4-oxo-quinazolin-7-yl]-4-methyl-N'-[(1R,2S,5S)-2,6,6-trimethylnorpinan-3-yl]-1,4-diazepane-1-carboxamidine CAS Name: N-[3-[2-(2-fluoro-4-methoxyphenyl)ethyl]-4-oxo-7-quinazolinyl]-4-methyl-N'-[(1S,4S,5R)-4,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl]-1,4-diazepane-1-carboximidamide IUPAC Name: N-[3-[2-(2-fluoro-4-methoxyphenyl)ethyl]-4-oxoquinazolin-7-yl]-4-methyl-N'-[(1S,4S,5R)-4,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl]-1,4-diazepane-1-carboximidamide Traditional Name: N-[3-[2-(2-fluoro-4-methoxy-phenyl)ethyl]-4-keto-quinazolin-7-yl]-4-methyl-N'-[(1R,2S,5S)-2,6,6-trimethylnorpinan-3-yl]-1,4-diazepane-1-carboxamidine Formula: C34H45FN6O2 MolecularWeight: 588.758503

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2CC(C2(C)C)CC1N=C(NC3=CC4=C(C=C3)C(=O)N(C=N4)CCC5=C(C=C(C=C5)OC)F)N6CCCN(CC6)C

Isomeric SMILES

C[C@H]1[C@H]2C[C@H](C2(C)C)CC1N=C(NC3=CC4=C(C=C3)C(=O)N(C=N4)CCC5=C(C=C(C=C5)OC)F)N6CCCN(CC6)C

InChI

InChI=1S/C34H45FN6O2/c1-22-28-17-24(34(28,2)3)18-30(22)38-33(40-13-6-12-39(4)15-16-40)37-25-8-10-27-31(19-25)36-21-41(32(27)42)14-11-23-7-9-26(43-5)20-29(23)35/h7-10,19-22,24,28,30H,6,11-18H2,1-5H3,(H,37,38)/t22-,24-,28+,30?/m0/s1