3-azanyl-6-(4-azanylpiperidin-1-yl)-4-[2,2,2-tris(fluoranyl)ethoxy]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-azanyl-6-(4-azanylpiperidin-1-yl)-4-[2,2,2-tris(fluoranyl)ethoxy]-1-benzothiophene-2-carboxamide Openeye Name: 3-amino-6-(4-amino-1-piperidyl)-4-(2,2,2-trifluoroethoxy)benzothiophene-2-carboxamide CAS Name: 3-amino-6-(4-amino-1-piperidinyl)-4-(2,2,2-trifluoroethoxy)-1-benzothiophene-2-carboxamide IUPAC Name: 3-amino-6-(4-aminopiperidin-1-yl)-4-(2,2,2-trifluoroethoxy)-1-benzothiophene-2-carboxamide Traditional Name: 3-amino-6-(4-aminopiperidino)-4-(2,2,2-trifluoroethoxy)benzothiophene-2-carboxamide Formula: C16H19F3N4O2S MolecularWeight: 388.40787

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N)C2=CC(=C3C(=C2)SC(=C3N)C(=O)N)OCC(F)(F)F

Isomeric SMILES

C1CN(CCC1N)C2=CC(=C3C(=C2)SC(=C3N)C(=O)N)OCC(F)(F)F

InChI

InChI=1S/C16H19F3N4O2S/c17-16(18,19)7-25-10-5-9(23-3-1-8(20)2-4-23)6-11-12(10)13(21)14(26-11)15(22)24/h5-6,8H,1-4,7,20-21H2,(H2,22,24)