1-(pyridin-4-ylmethyl)-3-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]urea

Systemtic Name: 1-(pyridin-4-ylmethyl)-3-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]urea Openeye Name: 1-(4-pyridylmethyl)-3-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]urea CAS Name: 1-(pyridin-4-ylmethyl)-3-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]urea IUPAC Name: 1-(pyridin-4-ylmethyl)-3-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]urea Traditional Name: 1-(4-pyridylmethyl)-3-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]urea Formula: C15H11F3N4OS MolecularWeight: 352.33425

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(F)(F)F)N=C(S2)NC(=O)NCC3=CC=NC=C3

Isomeric SMILES

C1=CC2=C(C=C1C(F)(F)F)N=C(S2)NC(=O)NCC3=CC=NC=C3

InChI

InChI=1S/C15H11F3N4OS/c16-15(17,18)10-1-2-12-11(7-10)21-14(24-12)22-13(23)20-8-9-3-5-19-6-4-9/h1-7H,8H2,(H2,20,21,22,23)