1-[4-(7-chloranyl-2-thiophen-2-yl-quinazolin-4-yl)piperazin-1-yl]-2-phenylmethoxy-ethanone

Systemtic Name: 1-[4-(7-chloranyl-2-thiophen-2-yl-quinazolin-4-yl)piperazin-1-yl]-2-phenylmethoxy-ethanone Openeye Name: 2-benzyloxy-1-[4-[7-chloro-2-(2-thienyl)quinazolin-4-yl]piperazin-1-yl]ethanone CAS Name: 1-[4-(7-chloro-2-thiophen-2-yl-4-quinazolinyl)-1-piperazinyl]-2-phenylmethoxyethanone IUPAC Name: 1-[4-(7-chloro-2-thiophen-2-ylquinazolin-4-yl)piperazin-1-yl]-2-phenylmethoxyethanone Traditional Name: 2-benzoxy-1-[4-[7-chloro-2-(2-thienyl)quinazolin-4-yl]piperazino]ethanone Formula: C25H23ClN4O2S MolecularWeight: 478.99372

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC(=NC3=C2C=CC(=C3)Cl)C4=CC=CS4)C(=O)COCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=NC(=NC3=C2C=CC(=C3)Cl)C4=CC=CS4)C(=O)COCC5=CC=CC=C5

InChI

InChI=1S/C25H23ClN4O2S/c26-19-8-9-20-21(15-19)27-24(22-7-4-14-33-22)28-25(20)30-12-10-29(11-13-30)23(31)17-32-16-18-5-2-1-3-6-18/h1-9,14-15H,10-13,16-17H2