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

Systemtic Name: N-[4-[(3,5-dimethoxyphenyl)methylsulfanylmethyl]-1,3-thiazol-2-yl]-4-methyl-benzamide Openeye Name: N-[4-[(3,5-dimethoxyphenyl)methylsulfanylmethyl]thiazol-2-yl]-4-methyl-benzamide CAS Name: N-[4-[[(3,5-dimethoxyphenyl)methylthio]methyl]-2-thiazolyl]-4-methylbenzamide IUPAC Name: N-[4-[(3,5-dimethoxyphenyl)methylsulfanylmethyl]-1,3-thiazol-2-yl]-4-methylbenzamide Traditional Name: N-[4-[[(3,5-dimethoxybenzyl)thio]methyl]thiazol-2-yl]-4-methyl-benzamide Formula: C21H22N2O3S2 MolecularWeight: 414.54098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=NC(=CS2)CSCC3=CC(=CC(=C3)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=NC(=CS2)CSCC3=CC(=CC(=C3)OC)OC

InChI

InChI=1S/C21H22N2O3S2/c1-14-4-6-16(7-5-14)20(24)23-21-22-17(13-28-21)12-27-11-15-8-18(25-2)10-19(9-15)26-3/h4-10,13H,11-12H2,1-3H3,(H,22,23,24)