N-[6-(dimethylamino)pyridin-3-yl]-4-fluoranyl-3-methyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[6-(dimethylamino)pyridin-3-yl]-4-fluoranyl-3-methyl-1-benzothiophene-2-carboxamide Openeye Name: N-[6-(dimethylamino)-3-pyridyl]-4-fluoro-3-methyl-benzothiophene-2-carboxamide CAS Name: N-[6-(dimethylamino)-3-pyridinyl]-4-fluoro-3-methyl-1-benzothiophene-2-carboxamide IUPAC Name: N-[6-(dimethylamino)pyridin-3-yl]-4-fluoro-3-methyl-1-benzothiophene-2-carboxamide Traditional Name: N-[6-(dimethylamino)-3-pyridyl]-4-fluoro-3-methyl-benzothiophene-2-carboxamide Formula: C17H16FN3OS MolecularWeight: 329.391843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC(=C12)F)C(=O)NC3=CN=C(C=C3)N(C)C

Isomeric SMILES

CC1=C(SC2=CC=CC(=C12)F)C(=O)NC3=CN=C(C=C3)N(C)C

InChI

InChI=1S/C17H16FN3OS/c1-10-15-12(18)5-4-6-13(15)23-16(10)17(22)20-11-7-8-14(19-9-11)21(2)3/h4-9H,1-3H3,(H,20,22)