3-[(3-chloranyl-1-benzothiophen-2-yl)methylsulfanyl]-4-(furan-2-ylmethyl)-1,2,4-triazole

Systemtic Name: 3-[(3-chloranyl-1-benzothiophen-2-yl)methylsulfanyl]-4-(furan-2-ylmethyl)-1,2,4-triazole Openeye Name: 3-[(3-chlorobenzothiophen-2-yl)methylsulfanyl]-4-(2-furylmethyl)-1,2,4-triazole CAS Name: 3-[(3-chloro-1-benzothiophen-2-yl)methylthio]-4-(2-furanylmethyl)-1,2,4-triazole IUPAC Name: 3-[(3-chloro-1-benzothiophen-2-yl)methylsulfanyl]-4-(furan-2-ylmethyl)-1,2,4-triazole Traditional Name: 3-[(3-chlorobenzothiophen-2-yl)methylthio]-4-(2-furfuryl)-1,2,4-triazole Formula: C16H12ClN3OS2 MolecularWeight: 361.86898

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)CSC3=NN=CN3CC4=CC=CO4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)CSC3=NN=CN3CC4=CC=CO4)Cl

InChI

InChI=1S/C16H12ClN3OS2/c17-15-12-5-1-2-6-13(12)23-14(15)9-22-16-19-18-10-20(16)8-11-4-3-7-21-11/h1-7,10H,8-9H2