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

Systemtic Name: 4-butyl-3-[[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-1H-1,2,4-triazol-5-one Openeye Name: 4-butyl-3-[[2-(3-methoxyphenyl)thiazol-4-yl]methylsulfanyl]-1H-1,2,4-triazol-5-one CAS Name: 4-butyl-3-[[2-(3-methoxyphenyl)-4-thiazolyl]methylthio]-1H-1,2,4-triazol-5-one IUPAC Name: 4-butyl-3-[[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-1H-1,2,4-triazol-5-one Traditional Name: 4-butyl-3-[[2-(3-methoxyphenyl)thiazol-4-yl]methylthio]-1H-1,2,4-triazol-5-one Formula: C17H20N4O2S2 MolecularWeight: 376.4963

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N4O2S2/c1-3-4-8-21-16(22)19-20-17(21)25-11-13-10-24-15(18-13)12-6-5-7-14(9-12)23-2/h5-7,9-10H,3-4,8,11H2,1-2H3,(H,19,22)