1-[4-[4-[(2,4-dichlorophenyl)methylamino]quinazolin-2-yl]piperazin-1-yl]-2-pyrrolidin-1-yl-ethanone

Systemtic Name: 1-[4-[4-[(2,4-dichlorophenyl)methylamino]quinazolin-2-yl]piperazin-1-yl]-2-pyrrolidin-1-yl-ethanone Openeye Name: 1-[4-[4-[(2,4-dichlorophenyl)methylamino]quinazolin-2-yl]piperazin-1-yl]-2-pyrrolidin-1-yl-ethanone CAS Name: 1-[4-[4-[(2,4-dichlorophenyl)methylamino]-2-quinazolinyl]-1-piperazinyl]-2-(1-pyrrolidinyl)ethanone IUPAC Name: 1-[4-[4-[(2,4-dichlorophenyl)methylamino]quinazolin-2-yl]piperazin-1-yl]-2-pyrrolidin-1-ylethanone Traditional Name: 1-[4-[4-[(2,4-dichlorobenzyl)amino]quinazolin-2-yl]piperazino]-2-pyrrolidino-ethanone Formula: C25H28Cl2N6O MolecularWeight: 499.43542

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC(=O)N2CCN(CC2)C3=NC4=CC=CC=C4C(=N3)NCC5=C(C=C(C=C5)Cl)Cl

Isomeric SMILES

C1CCN(C1)CC(=O)N2CCN(CC2)C3=NC4=CC=CC=C4C(=N3)NCC5=C(C=C(C=C5)Cl)Cl

InChI

InChI=1S/C25H28Cl2N6O/c26-19-8-7-18(21(27)15-19)16-28-24-20-5-1-2-6-22(20)29-25(30-24)33-13-11-32(12-14-33)23(34)17-31-9-3-4-10-31/h1-2,5-8,15H,3-4,9-14,16-17H2,(H,28,29,30)