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

Systemtic Name: 3-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methylsulfanyl]-4-(phenylmethyl)-1H-1,2,4-triazol-5-one Openeye Name: 4-benzyl-3-[(5-methyl-2-phenyl-oxazol-4-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one CAS Name: 3-[(5-methyl-2-phenyl-4-oxazolyl)methylthio]-4-(phenylmethyl)-1H-1,2,4-triazol-5-one IUPAC Name: 4-benzyl-3-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one Traditional Name: 4-benzyl-3-[(5-methyl-2-phenyl-oxazol-4-yl)methylthio]-1H-1,2,4-triazol-5-one Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CC=C2)CSC3=NNC(=O)N3CC4=CC=CC=C4

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CC=C2)CSC3=NNC(=O)N3CC4=CC=CC=C4

InChI

InChI=1S/C20H18N4O2S/c1-14-17(21-18(26-14)16-10-6-3-7-11-16)13-27-20-23-22-19(25)24(20)12-15-8-4-2-5-9-15/h2-11H,12-13H2,1H3,(H,22,25)