2-(6-ethyl-2-phenyl-quinazolin-4-yl)sulfanyl-1-piperidin-1-yl-ethanone

Systemtic Name: 2-(6-ethyl-2-phenyl-quinazolin-4-yl)sulfanyl-1-piperidin-1-yl-ethanone Openeye Name: 2-(6-ethyl-2-phenyl-quinazolin-4-yl)sulfanyl-1-(1-piperidyl)ethanone CAS Name: 2-[(6-ethyl-2-phenyl-4-quinazolinyl)thio]-1-(1-piperidinyl)ethanone IUPAC Name: 2-(6-ethyl-2-phenylquinazolin-4-yl)sulfanyl-1-piperidin-1-ylethanone Traditional Name: 2-[(6-ethyl-2-phenyl-quinazolin-4-yl)thio]-1-piperidino-ethanone Formula: C23H25N3OS MolecularWeight: 391.5291

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(N=C2SCC(=O)N3CCCCC3)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(N=C2SCC(=O)N3CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C23H25N3OS/c1-2-17-11-12-20-19(15-17)23(25-22(24-20)18-9-5-3-6-10-18)28-16-21(27)26-13-7-4-8-14-26/h3,5-6,9-12,15H,2,4,7-8,13-14,16H2,1H3