1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]urea

Systemtic Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]urea Openeye Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]urea CAS Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]urea IUPAC Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]urea Traditional Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]urea Formula: C18H14F3N3O4S MolecularWeight: 425.38167

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)NC3(OC4=CC=CC=C4O3)C(F)(F)F

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)NC3(OC4=CC=CC=C4O3)C(F)(F)F

InChI

InChI=1S/C18H14F3N3O4S/c1-2-26-10-7-8-11-14(9-10)29-16(22-11)23-15(25)24-18(17(19,20)21)27-12-5-3-4-6-13(12)28-18/h3-9H,2H2,1H3,(H2,22,23,24,25)