2-hexylsulfanyl-1H-quinazolin-4-one

Systemtic Name: 2-hexylsulfanyl-1H-quinazolin-4-one Openeye Name: 2-hexylsulfanyl-1H-quinazolin-4-one CAS Name: 2-(hexylthio)-1H-quinazolin-4-one IUPAC Name: 2-hexylsulfanyl-1H-quinazolin-4-one Traditional Name: 2-(hexylthio)-1H-quinazolin-4-one Formula: C14H18N2OS MolecularWeight: 262.37052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=NC(=O)C2=CC=CC=C2N1

Isomeric SMILES

CCCCCCSC1=NC(=O)C2=CC=CC=C2N1

InChI

InChI=1S/C14H18N2OS/c1-2-3-4-7-10-18-14-15-12-9-6-5-8-11(12)13(17)16-14/h5-6,8-9H,2-4,7,10H2,1H3,(H,15,16,17)