3-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methylsulfanyl]-4-phenethyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methylsulfanyl]-4-phenethyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[[5-methyl-2-(2-thienyl)oxazol-4-yl]methylsulfanyl]-4-phenethyl-1H-1,2,4-triazol-5-one CAS Name: 3-[(5-methyl-2-thiophen-2-yl-4-oxazolyl)methylthio]-4-phenethyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methylsulfanyl]-4-phenethyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[[5-methyl-2-(2-thienyl)oxazol-4-yl]methylthio]-4-phenethyl-1H-1,2,4-triazol-5-one Formula: C19H18N4O2S2 MolecularWeight: 398.50182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CS2)CSC3=NNC(=O)N3CCC4=CC=CC=C4

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CS2)CSC3=NNC(=O)N3CCC4=CC=CC=C4

InChI

InChI=1S/C19H18N4O2S2/c1-13-15(20-17(25-13)16-8-5-11-26-16)12-27-19-22-21-18(24)23(19)10-9-14-6-3-2-4-7-14/h2-8,11H,9-10,12H2,1H3,(H,21,24)