2-(oxan-2-ylmethylsulfanyl)-1H-quinazolin-4-one

Systemtic Name: 2-(oxan-2-ylmethylsulfanyl)-1H-quinazolin-4-one Openeye Name: 2-(tetrahydropyran-2-ylmethylsulfanyl)-1H-quinazolin-4-one CAS Name: 2-(2-oxanylmethylthio)-1H-quinazolin-4-one IUPAC Name: 2-(oxan-2-ylmethylsulfanyl)-1H-quinazolin-4-one Traditional Name: 2-(tetrahydropyran-2-ylmethylthio)-1H-quinazolin-4-one Formula: C14H16N2O2S MolecularWeight: 276.35404

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)CSC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

C1CCOC(C1)CSC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C14H16N2O2S/c17-13-11-6-1-2-7-12(11)15-14(16-13)19-9-10-5-3-4-8-18-10/h1-2,6-7,10H,3-5,8-9H2,(H,15,16,17)