(3R)-3-(fluoranylmethyl)-7-thiomorpholin-4-ylsulfonyl-3,4-dihydro-2H-isoquinolin-1-one

Systemtic Name: (3R)-3-(fluoranylmethyl)-7-thiomorpholin-4-ylsulfonyl-3,4-dihydro-2H-isoquinolin-1-one Openeye Name: (3R)-3-(fluoromethyl)-7-thiomorpholinosulfonyl-3,4-dihydro-2H-isoquinolin-1-one CAS Name: (3R)-3-(fluoromethyl)-7-thiomorpholin-4-ylsulfonyl-3,4-dihydro-2H-isoquinolin-1-one IUPAC Name: (3R)-3-(fluoromethyl)-7-thiomorpholin-4-ylsulfonyl-3,4-dihydro-2H-isoquinolin-1-one Traditional Name: (3R)-3-(fluoromethyl)-7-thiomorpholinosulfonyl-3,4-dihydroisocarbostyril Formula: C14H17FN2O3S2 MolecularWeight: 344.424783

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1S(=O)(=O)C2=CC3=C(CC(NC3=O)CF)C=C2

Isomeric SMILES

C1CSCCN1S(=O)(=O)C2=CC3=C(C[C@@H](NC3=O)CF)C=C2

InChI

InChI=1S/C14H17FN2O3S2/c15-9-11-7-10-1-2-12(8-13(10)14(18)16-11)22(19,20)17-3-5-21-6-4-17/h1-2,8,11H,3-7,9H2,(H,16,18)/t11-/m1/s1