2-tert-butyl-6-chloranyl-N-[[5-(trichloromethyl)-1,3,4-thiadiazol-2-yl]methyl]aniline

Systemtic Name: 2-tert-butyl-6-chloranyl-N-[[5-(trichloromethyl)-1,3,4-thiadiazol-2-yl]methyl]aniline Openeye Name: 2-tert-butyl-6-chloro-N-[[5-(trichloromethyl)-1,3,4-thiadiazol-2-yl]methyl]aniline CAS Name: 2-tert-butyl-6-chloro-N-[[5-(trichloromethyl)-1,3,4-thiadiazol-2-yl]methyl]aniline IUPAC Name: 2-tert-butyl-6-chloro-N-[[5-(trichloromethyl)-1,3,4-thiadiazol-2-yl]methyl]aniline Traditional Name: (2-tert-butyl-6-chloro-phenyl)-[[5-(trichloromethyl)-1,3,4-thiadiazol-2-yl]methyl]amine Formula: C14H15Cl4N3S MolecularWeight: 399.166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=CC=C1)Cl)NCC2=NN=C(S2)C(Cl)(Cl)Cl

Isomeric SMILES

CC(C)(C)C1=C(C(=CC=C1)Cl)NCC2=NN=C(S2)C(Cl)(Cl)Cl

InChI

InChI=1S/C14H15Cl4N3S/c1-13(2,3)8-5-4-6-9(15)11(8)19-7-10-20-21-12(22-10)14(16,17)18/h4-6,19H,7H2,1-3H3