2-[2-(4-fluoranylphenoxy)propanoylamino]-N-(phenylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[2-(4-fluoranylphenoxy)propanoylamino]-N-(phenylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-benzyl-2-[2-(4-fluorophenoxy)propanoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[2-(4-fluorophenoxy)-1-oxopropyl]amino]-N-(phenylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-benzyl-2-[2-(4-fluorophenoxy)propanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-benzyl-2-[2-(4-fluorophenoxy)propanoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C25H25FN2O3S MolecularWeight: 452.541003

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C2=C(S1)CCCC2)C(=O)NCC3=CC=CC=C3)OC4=CC=C(C=C4)F

Isomeric SMILES

CC(C(=O)NC1=C(C2=C(S1)CCCC2)C(=O)NCC3=CC=CC=C3)OC4=CC=C(C=C4)F

InChI

InChI=1S/C25H25FN2O3S/c1-16(31-19-13-11-18(26)12-14-19)23(29)28-25-22(20-9-5-6-10-21(20)32-25)24(30)27-15-17-7-3-2-4-8-17/h2-4,7-8,11-14,16H,5-6,9-10,15H2,1H3,(H,27,30)(H,28,29)