4-(2-propan-2-ylphenyl)-1-prop-2-enylsulfanyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one

Systemtic Name: 4-(2-propan-2-ylphenyl)-1-prop-2-enylsulfanyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Openeye Name: 1-allylsulfanyl-4-(2-isopropylphenyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-one CAS Name: 4-(2-propan-2-ylphenyl)-1-(prop-2-enylthio)-[1,2,4]triazolo[4,3-a]quinazolin-5-one IUPAC Name: 4-(2-propan-2-ylphenyl)-1-prop-2-enylsulfanyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Traditional Name: 1-(allylthio)-4-o-cumenyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Formula: C21H20N4OS MolecularWeight: 376.4747

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1N2C(=O)C3=CC=CC=C3N4C2=NN=C4SCC=C

Isomeric SMILES

CC(C)C1=CC=CC=C1N2C(=O)C3=CC=CC=C3N4C2=NN=C4SCC=C

InChI

InChI=1S/C21H20N4OS/c1-4-13-27-21-23-22-20-24(17-11-7-5-9-15(17)14(2)3)19(26)16-10-6-8-12-18(16)25(20)21/h4-12,14H,1,13H2,2-3H3