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

Systemtic Name: 2-[[6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-yl]amino]-5-prop-2-ynoxy-cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-[[6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-yl]amino]-5-prop-2-ynoxy-1,4-benzoquinone CAS Name: 2-[[6-methoxy-7-[3-(1-pyrrolidinyl)propoxy]-4-quinazolinyl]amino]-5-prop-2-ynoxycyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-[[6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-yl]amino]-5-prop-2-ynoxycyclohexa-2,5-diene-1,4-dione Traditional Name: 2-[[6-methoxy-7-(3-pyrrolidinopropoxy)quinazolin-4-yl]amino]-5-propargyloxy-p-benzoquinone Formula: C25H26N4O5 MolecularWeight: 462.49774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=O)C(=CC3=O)OCC#C)OCCCN4CCCC4

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=O)C(=CC3=O)OCC#C)OCCCN4CCCC4

InChI

InChI=1S/C25H26N4O5/c1-3-10-33-22-15-20(30)19(13-21(22)31)28-25-17-12-23(32-2)24(14-18(17)26-16-27-25)34-11-6-9-29-7-4-5-8-29/h1,12-16H,4-11H2,2H3,(H,26,27,28)