1-[[2,6-bis(chloranyl)phenyl]methyl]-4-chloranyl-3-isothiocyanato-pyrazole

Systemtic Name: 1-[[2,6-bis(chloranyl)phenyl]methyl]-4-chloranyl-3-isothiocyanato-pyrazole Openeye Name: 4-chloro-1-[(2,6-dichlorophenyl)methyl]-3-isothiocyanato-pyrazole CAS Name: 4-chloro-1-[(2,6-dichlorophenyl)methyl]-3-isothiocyanatopyrazole IUPAC Name: 4-chloro-1-[(2,6-dichlorophenyl)methyl]-3-isothiocyanatopyrazole Traditional Name: 4-chloro-1-(2,6-dichlorobenzyl)-3-isothiocyanato-pyrazole Formula: C11H6Cl3N3S MolecularWeight: 318.60944

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CN2C=C(C(=N2)N=C=S)Cl)Cl

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CN2C=C(C(=N2)N=C=S)Cl)Cl

InChI

InChI=1S/C11H6Cl3N3S/c12-8-2-1-3-9(13)7(8)4-17-5-10(14)11(16-17)15-6-18/h1-3,5H,4H2