N-[4-[(3-ethynylphenyl)amino]-7-methoxy-quinazolin-6-yl]-2-(4-propan-2-ylpiperazin-1-yl)ethanamide

Systemtic Name: N-[4-[(3-ethynylphenyl)amino]-7-methoxy-quinazolin-6-yl]-2-(4-propan-2-ylpiperazin-1-yl)ethanamide Openeye Name: N-[4-(3-ethynylanilino)-7-methoxy-quinazolin-6-yl]-2-(4-isopropylpiperazin-1-yl)acetamide CAS Name: N-[4-(3-ethynylanilino)-7-methoxy-6-quinazolinyl]-2-(4-propan-2-yl-1-piperazinyl)acetamide IUPAC Name: N-[4-(3-ethynylanilino)-7-methoxyquinazolin-6-yl]-2-(4-propan-2-ylpiperazin-1-yl)acetamide Traditional Name: N-[4-(3-ethynylanilino)-7-methoxy-quinazolin-6-yl]-2-(4-isopropylpiperazino)acetamide Formula: C26H30N6O2 MolecularWeight: 458.5554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)CC(=O)NC2=C(C=C3C(=C2)C(=NC=N3)NC4=CC=CC(=C4)C#C)OC

Isomeric SMILES

CC(C)N1CCN(CC1)CC(=O)NC2=C(C=C3C(=C2)C(=NC=N3)NC4=CC=CC(=C4)C#C)OC

InChI

InChI=1S/C26H30N6O2/c1-5-19-7-6-8-20(13-19)29-26-21-14-23(24(34-4)15-22(21)27-17-28-26)30-25(33)16-31-9-11-32(12-10-31)18(2)3/h1,6-8,13-15,17-18H,9-12,16H2,2-4H3,(H,30,33)(H,27,28,29)