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

Systemtic Name: 3-[[2,6-bis(chloranyl)phenyl]methylsulfanyl]-5-ethyl-4-propan-2-yl-1,2,4-triazole Openeye Name: 3-[(2,6-dichlorophenyl)methylsulfanyl]-5-ethyl-4-isopropyl-1,2,4-triazole CAS Name: 3-[(2,6-dichlorophenyl)methylthio]-5-ethyl-4-propan-2-yl-1,2,4-triazole IUPAC Name: 3-[(2,6-dichlorophenyl)methylsulfanyl]-5-ethyl-4-propan-2-yl-1,2,4-triazole Traditional Name: 3-[(2,6-dichlorobenzyl)thio]-5-ethyl-4-isopropyl-1,2,4-triazole Formula: C14H17Cl2N3S MolecularWeight: 330.27588

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1C(C)C)SCC2=C(C=CC=C2Cl)Cl

Isomeric SMILES

CCC1=NN=C(N1C(C)C)SCC2=C(C=CC=C2Cl)Cl

InChI

InChI=1S/C14H17Cl2N3S/c1-4-13-17-18-14(19(13)9(2)3)20-8-10-11(15)6-5-7-12(10)16/h5-7,9H,4,8H2,1-3H3