N-[4-[(4-fluorophenyl)methylsulfanylmethyl]-1,3-thiazol-2-yl]-3,4,5-trimethoxy-benzamide

Systemtic Name: N-[4-[(4-fluorophenyl)methylsulfanylmethyl]-1,3-thiazol-2-yl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[4-[(4-fluorophenyl)methylsulfanylmethyl]thiazol-2-yl]-3,4,5-trimethoxy-benzamide CAS Name: N-[4-[[(4-fluorophenyl)methylthio]methyl]-2-thiazolyl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[4-[(4-fluorophenyl)methylsulfanylmethyl]-1,3-thiazol-2-yl]-3,4,5-trimethoxybenzamide Traditional Name: N-[4-[[(4-fluorobenzyl)thio]methyl]thiazol-2-yl]-3,4,5-trimethoxy-benzamide Formula: C21H21FN2O4S2 MolecularWeight: 448.530843

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NC2=NC(=CS2)CSCC3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NC2=NC(=CS2)CSCC3=CC=C(C=C3)F

InChI

InChI=1S/C21H21FN2O4S2/c1-26-17-8-14(9-18(27-2)19(17)28-3)20(25)24-21-23-16(12-30-21)11-29-10-13-4-6-15(22)7-5-13/h4-9,12H,10-11H2,1-3H3,(H,23,24,25)