N-(2-bromanyl-5-methoxy-phenyl)-7-(3-methylsulfonylpropoxy)-5-piperidin-4-yloxy-quinazolin-4-amine

Systemtic Name: N-(2-bromanyl-5-methoxy-phenyl)-7-(3-methylsulfonylpropoxy)-5-piperidin-4-yloxy-quinazolin-4-amine Openeye Name: N-(2-bromo-5-methoxy-phenyl)-7-(3-methylsulfonylpropoxy)-5-(4-piperidyloxy)quinazolin-4-amine CAS Name: N-(2-bromo-5-methoxyphenyl)-7-(3-methylsulfonylpropoxy)-5-(4-piperidinyloxy)-4-quinazolinamine IUPAC Name: N-(2-bromo-5-methoxyphenyl)-7-(3-methylsulfonylpropoxy)-5-piperidin-4-yloxyquinazolin-4-amine Traditional Name: (2-bromo-5-methoxy-phenyl)-[7-(3-mesylpropoxy)-5-(4-piperidyloxy)quinazolin-4-yl]amine Formula: C24H29BrN4O5S MolecularWeight: 565.47986

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)NC2=NC=NC3=CC(=CC(=C32)OC4CCNCC4)OCCCS(=O)(=O)C

Isomeric SMILES

COC1=CC(=C(C=C1)Br)NC2=NC=NC3=CC(=CC(=C32)OC4CCNCC4)OCCCS(=O)(=O)C

InChI

InChI=1S/C24H29BrN4O5S/c1-32-17-4-5-19(25)20(12-17)29-24-23-21(27-15-28-24)13-18(33-10-3-11-35(2,30)31)14-22(23)34-16-6-8-26-9-7-16/h4-5,12-16,26H,3,6-11H2,1-2H3,(H,27,28,29)