3-[(5-chloranylthiophen-2-yl)methylsulfanyl]-4-(furan-2-ylmethyl)-5-phenyl-1,2,4-triazole

Systemtic Name: 3-[(5-chloranylthiophen-2-yl)methylsulfanyl]-4-(furan-2-ylmethyl)-5-phenyl-1,2,4-triazole Openeye Name: 3-[(5-chloro-2-thienyl)methylsulfanyl]-4-(2-furylmethyl)-5-phenyl-1,2,4-triazole CAS Name: 3-[(5-chloro-2-thiophenyl)methylthio]-4-(2-furanylmethyl)-5-phenyl-1,2,4-triazole IUPAC Name: 3-[(5-chlorothiophen-2-yl)methylsulfanyl]-4-(furan-2-ylmethyl)-5-phenyl-1,2,4-triazole Traditional Name: 3-[(5-chloro-2-thienyl)methylthio]-4-(2-furfuryl)-5-phenyl-1,2,4-triazole Formula: C18H14ClN3OS2 MolecularWeight: 387.90626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(N2CC3=CC=CO3)SCC4=CC=C(S4)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(N2CC3=CC=CO3)SCC4=CC=C(S4)Cl

InChI

InChI=1S/C18H14ClN3OS2/c19-16-9-8-15(25-16)12-24-18-21-20-17(13-5-2-1-3-6-13)22(18)11-14-7-4-10-23-14/h1-10H,11-12H2