2-[3-phenyl-5-(trifluoromethyl)pyrazol-1-yl]-4,5,6,7-tetrahydro-1,3-benzothiazole

Systemtic Name: 2-[3-phenyl-5-(trifluoromethyl)pyrazol-1-yl]-4,5,6,7-tetrahydro-1,3-benzothiazole Openeye Name: 2-[3-phenyl-5-(trifluoromethyl)pyrazol-1-yl]-4,5,6,7-tetrahydro-1,3-benzothiazole CAS Name: 2-[3-phenyl-5-(trifluoromethyl)-1-pyrazolyl]-4,5,6,7-tetrahydro-1,3-benzothiazole IUPAC Name: 2-[3-phenyl-5-(trifluoromethyl)pyrazol-1-yl]-4,5,6,7-tetrahydro-1,3-benzothiazole Traditional Name: 2-[3-phenyl-5-(trifluoromethyl)pyrazol-1-yl]-4,5,6,7-tetrahydro-1,3-benzothiazole Formula: C17H14F3N3S MolecularWeight: 349.37337

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)N=C(S2)N3C(=CC(=N3)C4=CC=CC=C4)C(F)(F)F

Isomeric SMILES

C1CCC2=C(C1)N=C(S2)N3C(=CC(=N3)C4=CC=CC=C4)C(F)(F)F

InChI

InChI=1S/C17H14F3N3S/c18-17(19,20)15-10-13(11-6-2-1-3-7-11)22-23(15)16-21-12-8-4-5-9-14(12)24-16/h1-3,6-7,10H,4-5,8-9H2