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

Systemtic Name: 2-tert-butyl-N-[[5-(trichloromethyl)-1,3,4-thiadiazol-2-yl]methyl]aniline Openeye Name: 2-tert-butyl-N-[[5-(trichloromethyl)-1,3,4-thiadiazol-2-yl]methyl]aniline CAS Name: 2-tert-butyl-N-[[5-(trichloromethyl)-1,3,4-thiadiazol-2-yl]methyl]aniline IUPAC Name: 2-tert-butyl-N-[[5-(trichloromethyl)-1,3,4-thiadiazol-2-yl]methyl]aniline Traditional Name: (2-tert-butylphenyl)-[[5-(trichloromethyl)-1,3,4-thiadiazol-2-yl]methyl]amine Formula: C14H16Cl3N3S MolecularWeight: 364.72094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1NCC2=NN=C(S2)C(Cl)(Cl)Cl

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1NCC2=NN=C(S2)C(Cl)(Cl)Cl

InChI

InChI=1S/C14H16Cl3N3S/c1-13(2,3)9-6-4-5-7-10(9)18-8-11-19-20-12(21-11)14(15,16)17/h4-7,18H,8H2,1-3H3