1-(7-azanyl-1,2-benzothiazol-4-yl)-3-[[4-(trifluoromethyl)phenyl]methyl]urea

Systemtic Name: 1-(7-azanyl-1,2-benzothiazol-4-yl)-3-[[4-(trifluoromethyl)phenyl]methyl]urea Openeye Name: 1-(7-amino-1,2-benzothiazol-4-yl)-3-[[4-(trifluoromethyl)phenyl]methyl]urea CAS Name: 1-(7-amino-1,2-benzothiazol-4-yl)-3-[[4-(trifluoromethyl)phenyl]methyl]urea IUPAC Name: 1-(7-amino-1,2-benzothiazol-4-yl)-3-[[4-(trifluoromethyl)phenyl]methyl]urea Traditional Name: 1-(7-amino-1,2-benzothiazol-4-yl)-3-[4-(trifluoromethyl)benzyl]urea Formula: C16H13F3N4OS MolecularWeight: 366.36083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)NC2=C3C=NSC3=C(C=C2)N)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)NC2=C3C=NSC3=C(C=C2)N)C(F)(F)F

InChI

InChI=1S/C16H13F3N4OS/c17-16(18,19)10-3-1-9(2-4-10)7-21-15(24)23-13-6-5-12(20)14-11(13)8-22-25-14/h1-6,8H,7,20H2,(H2,21,23,24)