2-(4-oxidanylbut-2-ynylsulfanyl)-3-phenyl-quinazolin-4-one

Systemtic Name: 2-(4-oxidanylbut-2-ynylsulfanyl)-3-phenyl-quinazolin-4-one Openeye Name: 2-(4-hydroxybut-2-ynylsulfanyl)-3-phenyl-quinazolin-4-one CAS Name: 2-(4-hydroxybut-2-ynylthio)-3-phenyl-4-quinazolinone IUPAC Name: 2-(4-hydroxybut-2-ynylsulfanyl)-3-phenylquinazolin-4-one Traditional Name: 2-(4-hydroxybut-2-ynylthio)-3-phenyl-quinazolin-4-one Formula: C18H14N2O2S MolecularWeight: 322.38096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC#CCO

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC#CCO

InChI

InChI=1S/C18H14N2O2S/c21-12-6-7-13-23-18-19-16-11-5-4-10-15(16)17(22)20(18)14-8-2-1-3-9-14/h1-5,8-11,21H,12-13H2