4-butyl-3-[[2-(4-ethoxy-3-methoxy-phenyl)-1,3-thiazol-4-yl]methylsulfanyl]-1H-1,2,4-triazol-5-one

Systemtic Name: 4-butyl-3-[[2-(4-ethoxy-3-methoxy-phenyl)-1,3-thiazol-4-yl]methylsulfanyl]-1H-1,2,4-triazol-5-one Openeye Name: 4-butyl-3-[[2-(4-ethoxy-3-methoxy-phenyl)thiazol-4-yl]methylsulfanyl]-1H-1,2,4-triazol-5-one CAS Name: 4-butyl-3-[[2-(4-ethoxy-3-methoxyphenyl)-4-thiazolyl]methylthio]-1H-1,2,4-triazol-5-one IUPAC Name: 4-butyl-3-[[2-(4-ethoxy-3-methoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-1H-1,2,4-triazol-5-one Traditional Name: 4-butyl-3-[[2-(4-ethoxy-3-methoxy-phenyl)thiazol-4-yl]methylthio]-1H-1,2,4-triazol-5-one Formula: C19H24N4O3S2 MolecularWeight: 420.54886

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24N4O3S2/c1-4-6-9-23-18(24)21-22-19(23)28-12-14-11-27-17(20-14)13-7-8-15(26-5-2)16(10-13)25-3/h7-8,10-11H,4-6,9,12H2,1-3H3,(H,21,24)