4-(furan-2-ylmethyl)-3-[(2-phenyl-1,3-thiazol-4-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one

Systemtic Name: 4-(furan-2-ylmethyl)-3-[(2-phenyl-1,3-thiazol-4-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one Openeye Name: 4-(2-furylmethyl)-3-[(2-phenylthiazol-4-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one CAS Name: 4-(2-furanylmethyl)-3-[(2-phenyl-4-thiazolyl)methylthio]-1H-1,2,4-triazol-5-one IUPAC Name: 4-(furan-2-ylmethyl)-3-[(2-phenyl-1,3-thiazol-4-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one Traditional Name: 4-(2-furfuryl)-3-[(2-phenylthiazol-4-yl)methylthio]-1H-1,2,4-triazol-5-one Formula: C17H14N4O2S2 MolecularWeight: 370.44866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=CS2)CSC3=NNC(=O)N3CC4=CC=CO4

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=CS2)CSC3=NNC(=O)N3CC4=CC=CO4

InChI

InChI=1S/C17H14N4O2S2/c22-16-19-20-17(21(16)9-14-7-4-8-23-14)25-11-13-10-24-15(18-13)12-5-2-1-3-6-12/h1-8,10H,9,11H2,(H,19,22)