1-[2-(4-butan-2-ylphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-propyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one

Systemtic Name: 1-[2-(4-butan-2-ylphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-propyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Openeye Name: 1-[2-oxo-2-(4-sec-butylphenyl)ethyl]sulfanyl-4-propyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one CAS Name: 1-[[2-(4-butan-2-ylphenyl)-2-oxoethyl]thio]-4-propyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one IUPAC Name: 1-[2-(4-butan-2-ylphenyl)-2-oxoethyl]sulfanyl-4-propyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Traditional Name: 1-[[2-keto-2-(4-sec-butylphenyl)ethyl]thio]-4-propyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Formula: C24H26N4O2S MolecularWeight: 434.55384

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N3C1=NN=C3SCC(=O)C4=CC=C(C=C4)C(C)CC

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N3C1=NN=C3SCC(=O)C4=CC=C(C=C4)C(C)CC

InChI

InChI=1S/C24H26N4O2S/c1-4-14-27-22(30)19-8-6-7-9-20(19)28-23(27)25-26-24(28)31-15-21(29)18-12-10-17(11-13-18)16(3)5-2/h6-13,16H,4-5,14-15H2,1-3H3