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

Systemtic Name: N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-3,5-dimethoxy-benzamide Openeye Name: N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-3,5-dimethoxy-benzamide CAS Name: N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-3,5-dimethoxybenzamide IUPAC Name: N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-3,5-dimethoxybenzamide Traditional Name: 3,5-dimethoxy-N-(5-veratryl-1,3,4-thiadiazol-2-yl)benzamide Formula: C20H21N3O5S MolecularWeight: 415.46284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2=NN=C(S2)NC(=O)C3=CC(=CC(=C3)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC2=NN=C(S2)NC(=O)C3=CC(=CC(=C3)OC)OC)OC

InChI

InChI=1S/C20H21N3O5S/c1-25-14-9-13(10-15(11-14)26-2)19(24)21-20-23-22-18(29-20)8-12-5-6-16(27-3)17(7-12)28-4/h5-7,9-11H,8H2,1-4H3,(H,21,23,24)