3-[[2,6-bis(chloranyl)phenyl]methylsulfanyl]-4-phenyl-5-thiophen-2-yl-1,2,4-triazole

Systemtic Name: 3-[[2,6-bis(chloranyl)phenyl]methylsulfanyl]-4-phenyl-5-thiophen-2-yl-1,2,4-triazole Openeye Name: 3-[(2,6-dichlorophenyl)methylsulfanyl]-4-phenyl-5-(2-thienyl)-1,2,4-triazole CAS Name: 3-[(2,6-dichlorophenyl)methylthio]-4-phenyl-5-thiophen-2-yl-1,2,4-triazole IUPAC Name: 3-[(2,6-dichlorophenyl)methylsulfanyl]-4-phenyl-5-thiophen-2-yl-1,2,4-triazole Traditional Name: 3-[(2,6-dichlorobenzyl)thio]-4-phenyl-5-(2-thienyl)-1,2,4-triazole Formula: C19H13Cl2N3S2 MolecularWeight: 418.36262

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SCC3=C(C=CC=C3Cl)Cl)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SCC3=C(C=CC=C3Cl)Cl)C4=CC=CS4

InChI

InChI=1S/C19H13Cl2N3S2/c20-15-8-4-9-16(21)14(15)12-26-19-23-22-18(17-10-5-11-25-17)24(19)13-6-2-1-3-7-13/h1-11H,12H2