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

Systemtic Name: 3-[4-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]piperazin-1-yl]carbonylchromen-2-one Openeye Name: 3-[4-(4,6-difluoro-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]chromen-2-one CAS Name: 3-[[4-(4,6-difluoro-1,3-benzothiazol-2-yl)-1-piperazinyl]-oxomethyl]-1-benzopyran-2-one IUPAC Name: 3-[4-(4,6-difluoro-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]chromen-2-one Traditional Name: 3-[4-(4,6-difluoro-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]coumarin Formula: C21H15F2N3O3S MolecularWeight: 427.423906

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=C(C=C(C=C3S2)F)F)C(=O)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

C1CN(CCN1C2=NC3=C(C=C(C=C3S2)F)F)C(=O)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C21H15F2N3O3S/c22-13-10-15(23)18-17(11-13)30-21(24-18)26-7-5-25(6-8-26)19(27)14-9-12-3-1-2-4-16(12)29-20(14)28/h1-4,9-11H,5-8H2