2-[4-(cyclohexylamino)quinazolin-2-yl]sulfanyl-1-(4-fluorophenyl)ethanone

Systemtic Name: 2-[4-(cyclohexylamino)quinazolin-2-yl]sulfanyl-1-(4-fluorophenyl)ethanone Openeye Name: 2-[4-(cyclohexylamino)quinazolin-2-yl]sulfanyl-1-(4-fluorophenyl)ethanone CAS Name: 2-[[4-(cyclohexylamino)-2-quinazolinyl]thio]-1-(4-fluorophenyl)ethanone IUPAC Name: 2-[4-(cyclohexylamino)quinazolin-2-yl]sulfanyl-1-(4-fluorophenyl)ethanone Traditional Name: 2-[[4-(cyclohexylamino)quinazolin-2-yl]thio]-1-(4-fluorophenyl)ethanone Formula: C22H22FN3OS MolecularWeight: 395.492983

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=NC(=NC3=CC=CC=C32)SCC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CCC(CC1)NC2=NC(=NC3=CC=CC=C32)SCC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H22FN3OS/c23-16-12-10-15(11-13-16)20(27)14-28-22-25-19-9-5-4-8-18(19)21(26-22)24-17-6-2-1-3-7-17/h4-5,8-13,17H,1-3,6-7,14H2,(H,24,25,26)