N-(4-cyanophenyl)-4-[6-methoxy-7-[2-(4-oxidanylidenepiperidin-1-yl)ethoxy]quinazolin-4-yl]piperazine-1-carboxamide

Systemtic Name: N-(4-cyanophenyl)-4-[6-methoxy-7-[2-(4-oxidanylidenepiperidin-1-yl)ethoxy]quinazolin-4-yl]piperazine-1-carboxamide Openeye Name: N-(4-cyanophenyl)-4-[6-methoxy-7-[2-(4-oxo-1-piperidyl)ethoxy]quinazolin-4-yl]piperazine-1-carboxamide CAS Name: N-(4-cyanophenyl)-4-[6-methoxy-7-[2-(4-oxo-1-piperidinyl)ethoxy]-4-quinazolinyl]-1-piperazinecarboxamide IUPAC Name: N-(4-cyanophenyl)-4-[6-methoxy-7-[2-(4-oxopiperidin-1-yl)ethoxy]quinazolin-4-yl]piperazine-1-carboxamide Traditional Name: N-(4-cyanophenyl)-4-[7-[2-(4-ketopiperidino)ethoxy]-6-methoxy-quinazolin-4-yl]piperazine-1-carboxamide Formula: C28H31N7O4 MolecularWeight: 529.59024

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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)OCCN5CCC(=O)CC5

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)C#N)OCCN5CCC(=O)CC5

InChI

InChI=1S/C28H31N7O4/c1-38-25-16-23-24(17-26(25)39-15-14-33-8-6-22(36)7-9-33)30-19-31-27(23)34-10-12-35(13-11-34)28(37)32-21-4-2-20(18-29)3-5-21/h2-5,16-17,19H,6-15H2,1H3,(H,32,37)