N-(6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)-5-pyrrolidin-1-ylsulfonyl-pyridin-2-amine

Systemtic Name: N-(6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)-5-pyrrolidin-1-ylsulfonyl-pyridin-2-amine Openeye Name: N-(6-fluorothiochroman-4-yl)-5-pyrrolidin-1-ylsulfonyl-pyridin-2-amine CAS Name: N-(6-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl)-5-(1-pyrrolidinylsulfonyl)-2-pyridinamine IUPAC Name: N-(6-fluoro-3,4-dihydro-2H-thiochromen-4-yl)-5-pyrrolidin-1-ylsulfonylpyridin-2-amine Traditional Name: (6-fluorothiochroman-4-yl)-(5-pyrrolidinosulfonyl-2-pyridyl)amine Formula: C18H20FN3O2S2 MolecularWeight: 393.498703

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)NC3CCSC4=C3C=C(C=C4)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)NC3CCSC4=C3C=C(C=C4)F

InChI

InChI=1S/C18H20FN3O2S2/c19-13-3-5-17-15(11-13)16(7-10-25-17)21-18-6-4-14(12-20-18)26(23,24)22-8-1-2-9-22/h3-6,11-12,16H,1-2,7-10H2,(H,20,21)