N-[3-[2-(2-fluoranyl-4-methoxy-phenyl)ethyl]-4-oxidanylidene-quinazolin-7-yl]-3-methyl-N'-[4-(trifluoromethyl)cyclohexyl]piperazine-1-carboximidamide

Systemtic Name: N-[3-[2-(2-fluoranyl-4-methoxy-phenyl)ethyl]-4-oxidanylidene-quinazolin-7-yl]-3-methyl-N'-[4-(trifluoromethyl)cyclohexyl]piperazine-1-carboximidamide Openeye Name: N-[3-[2-(2-fluoro-4-methoxy-phenyl)ethyl]-4-oxo-quinazolin-7-yl]-3-methyl-N'-[4-(trifluoromethyl)cyclohexyl]piperazine-1-carboxamidine CAS Name: N-[3-[2-(2-fluoro-4-methoxyphenyl)ethyl]-4-oxo-7-quinazolinyl]-3-methyl-N'-[4-(trifluoromethyl)cyclohexyl]-1-piperazinecarboximidamide IUPAC Name: N-[3-[2-(2-fluoro-4-methoxyphenyl)ethyl]-4-oxoquinazolin-7-yl]-3-methyl-N'-[4-(trifluoromethyl)cyclohexyl]piperazine-1-carboximidamide Traditional Name: N-[3-[2-(2-fluoro-4-methoxy-phenyl)ethyl]-4-keto-quinazolin-7-yl]-3-methyl-N'-[4-(trifluoromethyl)cyclohexyl]piperazine-1-carboxamidine Formula: C30H36F4N6O2 MolecularWeight: 588.639453

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)C(=NC2CCC(CC2)C(F)(F)F)NC3=CC4=C(C=C3)C(=O)N(C=N4)CCC5=C(C=C(C=C5)OC)F

Isomeric SMILES

CC1CN(CCN1)C(=NC2CCC(CC2)C(F)(F)F)NC3=CC4=C(C=C3)C(=O)N(C=N4)CCC5=C(C=C(C=C5)OC)F

InChI

InChI=1S/C30H36F4N6O2/c1-19-17-39(14-12-35-19)29(37-22-6-4-21(5-7-22)30(32,33)34)38-23-8-10-25-27(15-23)36-18-40(28(25)41)13-11-20-3-9-24(42-2)16-26(20)31/h3,8-10,15-16,18-19,21-22,35H,4-7,11-14,17H2,1-2H3,(H,37,38)