2-[3,4-dihydro-1H-isoquinolin-2-ylsulfonyl-bis(fluoranyl)methyl]-1,3-benzothiazole

Systemtic Name: 2-[3,4-dihydro-1H-isoquinolin-2-ylsulfonyl-bis(fluoranyl)methyl]-1,3-benzothiazole Openeye Name: 2-[3,4-dihydro-1H-isoquinolin-2-ylsulfonyl(difluoro)methyl]-1,3-benzothiazole CAS Name: 2-[3,4-dihydro-1H-isoquinolin-2-ylsulfonyl(difluoro)methyl]-1,3-benzothiazole IUPAC Name: 2-[3,4-dihydro-1H-isoquinolin-2-ylsulfonyl(difluoro)methyl]-1,3-benzothiazole Traditional Name: 2-[3,4-dihydro-1H-isoquinolin-2-ylsulfonyl(difluoro)methyl]-1,3-benzothiazole Formula: C17H14F2N2O2S2 MolecularWeight: 380.432066

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C(C3=NC4=CC=CC=C4S3)(F)F

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C(C3=NC4=CC=CC=C4S3)(F)F

InChI

InChI=1S/C17H14F2N2O2S2/c18-17(19,16-20-14-7-3-4-8-15(14)24-16)25(22,23)21-10-9-12-5-1-2-6-13(12)11-21/h1-8H,9-11H2