1-(6-methoxy-1,3-benzothiazol-2-yl)-3-[3-(trifluoromethyl)phenyl]urea

Systemtic Name: 1-(6-methoxy-1,3-benzothiazol-2-yl)-3-[3-(trifluoromethyl)phenyl]urea Openeye Name: 1-(6-methoxy-1,3-benzothiazol-2-yl)-3-[3-(trifluoromethyl)phenyl]urea CAS Name: 1-(6-methoxy-1,3-benzothiazol-2-yl)-3-[3-(trifluoromethyl)phenyl]urea IUPAC Name: 1-(6-methoxy-1,3-benzothiazol-2-yl)-3-[3-(trifluoromethyl)phenyl]urea Traditional Name: 1-(6-methoxy-1,3-benzothiazol-2-yl)-3-[3-(trifluoromethyl)phenyl]urea Formula: C16H12F3N3O2S MolecularWeight: 367.34559

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C16H12F3N3O2S/c1-24-11-5-6-12-13(8-11)25-15(21-12)22-14(23)20-10-4-2-3-9(7-10)16(17,18)19/h2-8H,1H3,(H2,20,21,22,23)