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

Systemtic Name: 1-(azepan-1-yl)-2-(6-ethyl-2-phenyl-quinazolin-4-yl)sulfanyl-ethanone Openeye Name: 1-(azepan-1-yl)-2-(6-ethyl-2-phenyl-quinazolin-4-yl)sulfanyl-ethanone CAS Name: 1-(1-azepanyl)-2-[(6-ethyl-2-phenyl-4-quinazolinyl)thio]ethanone IUPAC Name: 1-(azepan-1-yl)-2-(6-ethyl-2-phenylquinazolin-4-yl)sulfanylethanone Traditional Name: 1-(azepan-1-yl)-2-[(6-ethyl-2-phenyl-quinazolin-4-yl)thio]ethanone Formula: C24H27N3OS MolecularWeight: 405.55568

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(N=C2SCC(=O)N3CCCCCC3)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(N=C2SCC(=O)N3CCCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C24H27N3OS/c1-2-18-12-13-21-20(16-18)24(26-23(25-21)19-10-6-5-7-11-19)29-17-22(28)27-14-8-3-4-9-15-27/h5-7,10-13,16H,2-4,8-9,14-15,17H2,1H3