2-[(2-fluoranylphenoxy)methyl]-N-[2-(heptanoylamino)ethyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[(2-fluoranylphenoxy)methyl]-N-[2-(heptanoylamino)ethyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[(2-fluorophenoxy)methyl]-N-[2-(heptanoylamino)ethyl]thiazole-4-carboxamide CAS Name: 2-[(2-fluorophenoxy)methyl]-N-[2-(1-oxoheptylamino)ethyl]-4-thiazolecarboxamide IUPAC Name: 2-[(2-fluorophenoxy)methyl]-N-[2-(heptanoylamino)ethyl]-1,3-thiazole-4-carboxamide Traditional Name: N-[2-(enanthylamino)ethyl]-2-[(2-fluorophenoxy)methyl]thiazole-4-carboxamide Formula: C20H26FN3O3S MolecularWeight: 407.502143

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)NCCNC(=O)C1=CSC(=N1)COC2=CC=CC=C2F

Isomeric SMILES

CCCCCCC(=O)NCCNC(=O)C1=CSC(=N1)COC2=CC=CC=C2F

InChI

InChI=1S/C20H26FN3O3S/c1-2-3-4-5-10-18(25)22-11-12-23-20(26)16-14-28-19(24-16)13-27-17-9-7-6-8-15(17)21/h6-9,14H,2-5,10-13H2,1H3,(H,22,25)(H,23,26)