2-but-3-yn-2-yloxy-5-[[6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-yl]amino]cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2-but-3-yn-2-yloxy-5-[[6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-yl]amino]cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-[[6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-yl]amino]-5-(1-methylprop-2-ynoxy)-1,4-benzoquinone CAS Name: 2-but-3-yn-2-yloxy-5-[[6-methoxy-7-[3-(1-pyrrolidinyl)propoxy]-4-quinazolinyl]amino]cyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-but-3-yn-2-yloxy-5-[[6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-yl]amino]cyclohexa-2,5-diene-1,4-dione Traditional Name: 2-[[6-methoxy-7-(3-pyrrolidinopropoxy)quinazolin-4-yl]amino]-5-(1-methylprop-2-ynoxy)-p-benzoquinone Formula: C26H28N4O5 MolecularWeight: 476.52432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#C)OC1=CC(=O)C(=CC1=O)NC2=NC=NC3=CC(=C(C=C32)OC)OCCCN4CCCC4

Isomeric SMILES

CC(C#C)OC1=CC(=O)C(=CC1=O)NC2=NC=NC3=CC(=C(C=C32)OC)OCCCN4CCCC4

InChI

InChI=1S/C26H28N4O5/c1-4-17(2)35-23-15-21(31)20(13-22(23)32)29-26-18-12-24(33-3)25(14-19(18)27-16-28-26)34-11-7-10-30-8-5-6-9-30/h1,12-17H,5-11H2,2-3H3,(H,27,28,29)