N-(2-chloranyl-5-methoxy-phenyl)-5-cyclohexyloxy-7-phenylmethoxy-quinazolin-4-amine

Systemtic Name: N-(2-chloranyl-5-methoxy-phenyl)-5-cyclohexyloxy-7-phenylmethoxy-quinazolin-4-amine Openeye Name: 7-benzyloxy-N-(2-chloro-5-methoxy-phenyl)-5-(cyclohexoxy)quinazolin-4-amine CAS Name: N-(2-chloro-5-methoxyphenyl)-5-cyclohexyloxy-7-phenylmethoxy-4-quinazolinamine IUPAC Name: N-(2-chloro-5-methoxyphenyl)-5-cyclohexyloxy-7-phenylmethoxyquinazolin-4-amine Traditional Name: [7-benzoxy-5-(cyclohexoxy)quinazolin-4-yl]-(2-chloro-5-methoxy-phenyl)amine Formula: C28H28ClN3O3 MolecularWeight: 489.99322

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Cl)NC2=NC=NC3=CC(=CC(=C32)OC4CCCCC4)OCC5=CC=CC=C5

Isomeric SMILES

COC1=CC(=C(C=C1)Cl)NC2=NC=NC3=CC(=CC(=C32)OC4CCCCC4)OCC5=CC=CC=C5

InChI

InChI=1S/C28H28ClN3O3/c1-33-21-12-13-23(29)24(14-21)32-28-27-25(30-18-31-28)15-22(34-17-19-8-4-2-5-9-19)16-26(27)35-20-10-6-3-7-11-20/h2,4-5,8-9,12-16,18,20H,3,6-7,10-11,17H2,1H3,(H,30,31,32)