1-(2-oxidanylidenepropylsulfanyl)-4-phenyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one

Systemtic Name: 1-(2-oxidanylidenepropylsulfanyl)-4-phenyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Openeye Name: 1-acetonylsulfanyl-4-phenyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one CAS Name: 1-(2-oxopropylthio)-4-phenyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one IUPAC Name: 1-(2-oxopropylsulfanyl)-4-phenyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Traditional Name: 1-(acetonylthio)-4-phenyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Formula: C18H14N4O2S MolecularWeight: 350.39436

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=NN=C2N1C3=CC=CC=C3C(=O)N2C4=CC=CC=C4

Isomeric SMILES

CC(=O)CSC1=NN=C2N1C3=CC=CC=C3C(=O)N2C4=CC=CC=C4

InChI

InChI=1S/C18H14N4O2S/c1-12(23)11-25-18-20-19-17-21(13-7-3-2-4-8-13)16(24)14-9-5-6-10-15(14)22(17)18/h2-10H,11H2,1H3