4-butyl-3-[[2-(4-propan-2-ylphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-1H-1,2,4-triazol-5-one

Systemtic Name: 4-butyl-3-[[2-(4-propan-2-ylphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-1H-1,2,4-triazol-5-one Openeye Name: 4-butyl-3-[[2-(4-isopropylphenyl)thiazol-4-yl]methylsulfanyl]-1H-1,2,4-triazol-5-one CAS Name: 4-butyl-3-[[2-(4-propan-2-ylphenyl)-4-thiazolyl]methylthio]-1H-1,2,4-triazol-5-one IUPAC Name: 4-butyl-3-[[2-(4-propan-2-ylphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-1H-1,2,4-triazol-5-one Traditional Name: 4-butyl-3-[(2-p-cumenylthiazol-4-yl)methylthio]-1H-1,2,4-triazol-5-one Formula: C19H24N4OS2 MolecularWeight: 388.55006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)NN=C1SCC2=CSC(=N2)C3=CC=C(C=C3)C(C)C

Isomeric SMILES

CCCCN1C(=O)NN=C1SCC2=CSC(=N2)C3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C19H24N4OS2/c1-4-5-10-23-18(24)21-22-19(23)26-12-16-11-25-17(20-16)15-8-6-14(7-9-15)13(2)3/h6-9,11,13H,4-5,10,12H2,1-3H3,(H,21,24)