1-[4-(1,2-benzothiazol-5-yloxy)-3-(trifluoromethyl)phenyl]-3-methyl-urea

Systemtic Name: 1-[4-(1,2-benzothiazol-5-yloxy)-3-(trifluoromethyl)phenyl]-3-methyl-urea Openeye Name: 1-[4-(1,2-benzothiazol-5-yloxy)-3-(trifluoromethyl)phenyl]-3-methyl-urea CAS Name: 1-[4-(1,2-benzothiazol-5-yloxy)-3-(trifluoromethyl)phenyl]-3-methylurea IUPAC Name: 1-[4-(1,2-benzothiazol-5-yloxy)-3-(trifluoromethyl)phenyl]-3-methylurea Traditional Name: 1-[4-(1,2-benzothiazol-5-yloxy)-3-(trifluoromethyl)phenyl]-3-methyl-urea Formula: C16H12F3N3O2S MolecularWeight: 367.34559

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC1=CC(=C(C=C1)OC2=CC3=C(C=C2)SN=C3)C(F)(F)F

Isomeric SMILES

CNC(=O)NC1=CC(=C(C=C1)OC2=CC3=C(C=C2)SN=C3)C(F)(F)F

InChI

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