3-(1,3-benzothiazol-2-yl)-7-oxidanyl-8-(piperidin-1-ylmethyl)-2-(trifluoromethyl)chromen-4-one

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-7-oxidanyl-8-(piperidin-1-ylmethyl)-2-(trifluoromethyl)chromen-4-one Openeye Name: 3-(1,3-benzothiazol-2-yl)-7-hydroxy-8-(1-piperidylmethyl)-2-(trifluoromethyl)chromen-4-one CAS Name: 3-(1,3-benzothiazol-2-yl)-7-hydroxy-8-(1-piperidinylmethyl)-2-(trifluoromethyl)-1-benzopyran-4-one IUPAC Name: 3-(1,3-benzothiazol-2-yl)-7-hydroxy-8-(piperidin-1-ylmethyl)-2-(trifluoromethyl)chromen-4-one Traditional Name: 3-(1,3-benzothiazol-2-yl)-7-hydroxy-8-(piperidinomethyl)-2-(trifluoromethyl)chromone Formula: C23H19F3N2O3S MolecularWeight: 460.46877

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=C(C=CC3=C2OC(=C(C3=O)C4=NC5=CC=CC=C5S4)C(F)(F)F)O

Isomeric SMILES

C1CCN(CC1)CC2=C(C=CC3=C2OC(=C(C3=O)C4=NC5=CC=CC=C5S4)C(F)(F)F)O

InChI

InChI=1S/C23H19F3N2O3S/c24-23(25,26)21-18(22-27-15-6-2-3-7-17(15)32-22)19(30)13-8-9-16(29)14(20(13)31-21)12-28-10-4-1-5-11-28/h2-3,6-9,29H,1,4-5,10-12H2