N-(4-cyanophenyl)-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinazolin-4-yl]piperazine-1-carboxamide

Systemtic Name: N-(4-cyanophenyl)-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinazolin-4-yl]piperazine-1-carboxamide Openeye Name: N-(4-cyanophenyl)-4-[6-methoxy-7-(3-morpholinopropoxy)quinazolin-4-yl]piperazine-1-carboxamide CAS Name: N-(4-cyanophenyl)-4-[6-methoxy-7-[3-(4-morpholinyl)propoxy]-4-quinazolinyl]-1-piperazinecarboxamide IUPAC Name: N-(4-cyanophenyl)-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinazolin-4-yl]piperazine-1-carboxamide Traditional Name: N-(4-cyanophenyl)-4-[6-methoxy-7-(3-morpholinopropoxy)quinazolin-4-yl]piperazine-1-carboxamide Formula: C28H33N7O4 MolecularWeight: 531.60612

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)C#N)OCCCN5CCOCC5

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)C#N)OCCCN5CCOCC5

InChI

InChI=1S/C28H33N7O4/c1-37-25-17-23-24(18-26(25)39-14-2-7-33-12-15-38-16-13-33)30-20-31-27(23)34-8-10-35(11-9-34)28(36)32-22-5-3-21(19-29)4-6-22/h3-6,17-18,20H,2,7-16H2,1H3,(H,32,36)