N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-6-pyridin-4-yl-1,3-benzothiazol-2-amine

Systemtic Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-6-pyridin-4-yl-1,3-benzothiazol-2-amine Openeye Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-6-(4-pyridyl)-1,3-benzothiazol-2-amine CAS Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-6-pyridin-4-yl-1,3-benzothiazol-2-amine IUPAC Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-6-pyridin-4-yl-1,3-benzothiazol-2-amine Traditional Name: [3,5-bis(trifluoromethyl)benzyl]-[6-(4-pyridyl)-1,3-benzothiazol-2-yl]amine Formula: C21H13F6N3S MolecularWeight: 453.403439

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C3=CC=NC=C3)SC(=N2)NCC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC2=C(C=C1C3=CC=NC=C3)SC(=N2)NCC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C21H13F6N3S/c22-20(23,24)15-7-12(8-16(10-15)21(25,26)27)11-29-19-30-17-2-1-14(9-18(17)31-19)13-3-5-28-6-4-13/h1-10H,11H2,(H,29,30)