N-[5-chloranyl-7-(oxolan-3-ylmethoxymethyl)-1,3-benzodioxol-4-yl]-6-methoxy-7-(3-morpholin-4-ylpropoxy)quinazolin-4-amine

Systemtic Name: N-[5-chloranyl-7-(oxolan-3-ylmethoxymethyl)-1,3-benzodioxol-4-yl]-6-methoxy-7-(3-morpholin-4-ylpropoxy)quinazolin-4-amine Openeye Name: N-[5-chloro-7-(tetrahydrofuran-3-ylmethoxymethyl)-1,3-benzodioxol-4-yl]-6-methoxy-7-(3-morpholinopropoxy)quinazolin-4-amine CAS Name: N-[5-chloro-7-(3-oxolanylmethoxymethyl)-1,3-benzodioxol-4-yl]-6-methoxy-7-[3-(4-morpholinyl)propoxy]-4-quinazolinamine IUPAC Name: N-[5-chloro-7-(oxolan-3-ylmethoxymethyl)-1,3-benzodioxol-4-yl]-6-methoxy-7-(3-morpholin-4-ylpropoxy)quinazolin-4-amine Traditional Name: [5-chloro-7-(tetrahydrofuran-3-ylmethoxymethyl)-1,3-benzodioxol-4-yl]-[6-methoxy-7-(3-morpholinopropoxy)quinazolin-4-yl]amine Formula: C29H35ClN4O7 MolecularWeight: 587.0638

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=C(C4=C3OCO4)COCC5CCOC5)Cl)OCCCN6CCOCC6

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=C(C4=C3OCO4)COCC5CCOC5)Cl)OCCCN6CCOCC6

InChI

InChI=1S/C29H35ClN4O7/c1-35-24-12-21-23(13-25(24)39-7-2-4-34-5-9-36-10-6-34)31-17-32-29(21)33-26-22(30)11-20(27-28(26)41-18-40-27)16-38-15-19-3-8-37-14-19/h11-13,17,19H,2-10,14-16,18H2,1H3,(H,31,32,33)