N-(6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)-7-methoxy-2-methyl-quinoline-3-carboxamide

Systemtic Name: N-(6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)-7-methoxy-2-methyl-quinoline-3-carboxamide Openeye Name: N-(6-fluorothiochroman-4-yl)-7-methoxy-2-methyl-quinoline-3-carboxamide CAS Name: N-(6-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl)-7-methoxy-2-methyl-3-quinolinecarboxamide IUPAC Name: N-(6-fluoro-3,4-dihydro-2H-thiochromen-4-yl)-7-methoxy-2-methylquinoline-3-carboxamide Traditional Name: N-(6-fluorothiochroman-4-yl)-7-methoxy-2-methyl-quinoline-3-carboxamide Formula: C21H19FN2O2S MolecularWeight: 382.451163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=CC(=CC2=N1)OC)C(=O)NC3CCSC4=C3C=C(C=C4)F

Isomeric SMILES

CC1=C(C=C2C=CC(=CC2=N1)OC)C(=O)NC3CCSC4=C3C=C(C=C4)F

InChI

InChI=1S/C21H19FN2O2S/c1-12-16(9-13-3-5-15(26-2)11-19(13)23-12)21(25)24-18-7-8-27-20-6-4-14(22)10-17(18)20/h3-6,9-11,18H,7-8H2,1-2H3,(H,24,25)