3-[4-[6-(trifluoromethyloxy)-1,3-benzothiazol-2-yl]piperazin-1-yl]carbonylchromen-2-one

Systemtic Name: 3-[4-[6-(trifluoromethyloxy)-1,3-benzothiazol-2-yl]piperazin-1-yl]carbonylchromen-2-one Openeye Name: 3-[4-[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]piperazine-1-carbonyl]chromen-2-one CAS Name: 3-[oxo-[4-[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]-1-piperazinyl]methyl]-1-benzopyran-2-one IUPAC Name: 3-[4-[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]piperazine-1-carbonyl]chromen-2-one Traditional Name: 3-[4-[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]piperazine-1-carbonyl]coumarin Formula: C22H16F3N3O4S MolecularWeight: 475.44035

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=C(S2)C=C(C=C3)OC(F)(F)F)C(=O)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

C1CN(CCN1C2=NC3=C(S2)C=C(C=C3)OC(F)(F)F)C(=O)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C22H16F3N3O4S/c23-22(24,25)32-14-5-6-16-18(12-14)33-21(26-16)28-9-7-27(8-10-28)19(29)15-11-13-3-1-2-4-17(13)31-20(15)30/h1-6,11-12H,7-10H2