3-(1,3-benzothiazol-2-yl)-1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-1-methyl-urea

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-1-methyl-urea Openeye Name: 3-(1,3-benzothiazol-2-yl)-1-[(2-chloro-6-fluoro-phenyl)methyl]-1-methyl-urea CAS Name: 3-(1,3-benzothiazol-2-yl)-1-[(2-chloro-6-fluorophenyl)methyl]-1-methylurea IUPAC Name: 3-(1,3-benzothiazol-2-yl)-1-[(2-chloro-6-fluorophenyl)methyl]-1-methylurea Traditional Name: 3-(1,3-benzothiazol-2-yl)-1-(2-chloro-6-fluoro-benzyl)-1-methyl-urea Formula: C16H13ClFN3OS MolecularWeight: 349.810323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC=C1Cl)F)C(=O)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

CN(CC1=C(C=CC=C1Cl)F)C(=O)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H13ClFN3OS/c1-21(9-10-11(17)5-4-6-12(10)18)16(22)20-15-19-13-7-2-3-8-14(13)23-15/h2-8H,9H2,1H3,(H,19,20,22)