N-[4-[[2-(3-fluoranylphenoxy)pyridin-3-yl]methylamino]-4-oxidanylidene-butyl]thiophene-3-carboxamide

Systemtic Name: N-[4-[[2-(3-fluoranylphenoxy)pyridin-3-yl]methylamino]-4-oxidanylidene-butyl]thiophene-3-carboxamide Openeye Name: N-[4-[[2-(3-fluorophenoxy)-3-pyridyl]methylamino]-4-oxo-butyl]thiophene-3-carboxamide CAS Name: N-[4-[[2-(3-fluorophenoxy)-3-pyridinyl]methylamino]-4-oxobutyl]-3-thiophenecarboxamide IUPAC Name: N-[4-[[2-(3-fluorophenoxy)pyridin-3-yl]methylamino]-4-oxobutyl]thiophene-3-carboxamide Traditional Name: N-[4-[[2-(3-fluorophenoxy)-3-pyridyl]methylamino]-4-keto-butyl]thiophene-3-carboxamide Formula: C21H20FN3O3S MolecularWeight: 413.465203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)OC2=C(C=CC=N2)CNC(=O)CCCNC(=O)C3=CSC=C3

Isomeric SMILES

C1=CC(=CC(=C1)F)OC2=C(C=CC=N2)CNC(=O)CCCNC(=O)C3=CSC=C3

InChI

InChI=1S/C21H20FN3O3S/c22-17-5-1-6-18(12-17)28-21-15(4-2-10-24-21)13-25-19(26)7-3-9-23-20(27)16-8-11-29-14-16/h1-2,4-6,8,10-12,14H,3,7,9,13H2,(H,23,27)(H,25,26)