1-(1-adamantyl)-2-quinazolin-4-ylsulfanyl-ethanone

Systemtic Name: 1-(1-adamantyl)-2-quinazolin-4-ylsulfanyl-ethanone Openeye Name: 1-(1-adamantyl)-2-quinazolin-4-ylsulfanyl-ethanone CAS Name: 1-(1-adamantyl)-2-(4-quinazolinylthio)ethanone IUPAC Name: 1-(1-adamantyl)-2-quinazolin-4-ylsulfanylethanone Traditional Name: 1-(1-adamantyl)-2-(quinazolin-4-ylthio)ethanone Formula: C20H22N2OS MolecularWeight: 338.46648

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)CSC4=NC=NC5=CC=CC=C54

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)CSC4=NC=NC5=CC=CC=C54

InChI

InChI=1S/C20H22N2OS/c23-18(20-8-13-5-14(9-20)7-15(6-13)10-20)11-24-19-16-3-1-2-4-17(16)21-12-22-19/h1-4,12-15H,5-11H2