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

Systemtic Name: N-(4-cyanophenyl)-4-[6-methoxy-7-(2-piperazin-1-ylethoxy)quinazolin-4-yl]piperazine-1-carboxamide Openeye Name: N-(4-cyanophenyl)-4-[6-methoxy-7-(2-piperazin-1-ylethoxy)quinazolin-4-yl]piperazine-1-carboxamide CAS Name: N-(4-cyanophenyl)-4-[6-methoxy-7-[2-(1-piperazinyl)ethoxy]-4-quinazolinyl]-1-piperazinecarboxamide IUPAC Name: N-(4-cyanophenyl)-4-[6-methoxy-7-(2-piperazin-1-ylethoxy)quinazolin-4-yl]piperazine-1-carboxamide Traditional Name: N-(4-cyanophenyl)-4-[6-methoxy-7-(2-piperazinoethoxy)quinazolin-4-yl]piperazine-1-carboxamide Formula: C27H32N8O3 MolecularWeight: 516.59478

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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)OCCN5CCNCC5

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)C#N)OCCN5CCNCC5

InChI

InChI=1S/C27H32N8O3/c1-37-24-16-22-23(17-25(24)38-15-14-33-8-6-29-7-9-33)30-19-31-26(22)34-10-12-35(13-11-34)27(36)32-21-4-2-20(18-28)3-5-21/h2-5,16-17,19,29H,6-15H2,1H3,(H,32,36)