1-(2-methylpropylsulfanyl)-4-propyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one

Systemtic Name: 1-(2-methylpropylsulfanyl)-4-propyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Openeye Name: 1-isobutylsulfanyl-4-propyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one CAS Name: 1-(2-methylpropylthio)-4-propyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one IUPAC Name: 1-(2-methylpropylsulfanyl)-4-propyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Traditional Name: 1-(isobutylthio)-4-propyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Formula: C16H20N4OS MolecularWeight: 316.4212

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N3C1=NN=C3SCC(C)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N3C1=NN=C3SCC(C)C

InChI

InChI=1S/C16H20N4OS/c1-4-9-19-14(21)12-7-5-6-8-13(12)20-15(19)17-18-16(20)22-10-11(2)3/h5-8,11H,4,9-10H2,1-3H3