1-[(1-ethylpyrrolidin-2-yl)methyl]-3-[4-[(3-ethynylphenyl)amino]quinazolin-7-yl]imidazol-2-one

Systemtic Name: 1-[(1-ethylpyrrolidin-2-yl)methyl]-3-[4-[(3-ethynylphenyl)amino]quinazolin-7-yl]imidazol-2-one Openeye Name: 1-[(1-ethylpyrrolidin-2-yl)methyl]-3-[4-(3-ethynylanilino)quinazolin-7-yl]imidazol-2-one CAS Name: 1-[(1-ethyl-2-pyrrolidinyl)methyl]-3-[4-(3-ethynylanilino)-7-quinazolinyl]-2-imidazolone IUPAC Name: 1-[(1-ethylpyrrolidin-2-yl)methyl]-3-[4-(3-ethynylanilino)quinazolin-7-yl]imidazol-2-one Traditional Name: 1-[(1-ethylpyrrolidin-2-yl)methyl]-3-[4-(3-ethynylanilino)quinazolin-7-yl]-4-imidazolin-2-one Formula: C26H26N6O MolecularWeight: 438.52424

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CN2C=CN(C2=O)C3=CC4=C(C=C3)C(=NC=N4)NC5=CC=CC(=C5)C#C

Isomeric SMILES

CCN1CCCC1CN2C=CN(C2=O)C3=CC4=C(C=C3)C(=NC=N4)NC5=CC=CC(=C5)C#C

InChI

InChI=1S/C26H26N6O/c1-3-19-7-5-8-20(15-19)29-25-23-11-10-21(16-24(23)27-18-28-25)32-14-13-31(26(32)33)17-22-9-6-12-30(22)4-2/h1,5,7-8,10-11,13-16,18,22H,4,6,9,12,17H2,2H3,(H,27,28,29)