N-[5-(2-bromanylnaphthalen-1-yl)-1,3,4-thiadiazol-2-yl]-2,6-dimethoxy-benzamide

Systemtic Name: N-[5-(2-bromanylnaphthalen-1-yl)-1,3,4-thiadiazol-2-yl]-2,6-dimethoxy-benzamide Openeye Name: N-[5-(2-bromo-1-naphthyl)-1,3,4-thiadiazol-2-yl]-2,6-dimethoxy-benzamide CAS Name: N-[5-(2-bromo-1-naphthalenyl)-1,3,4-thiadiazol-2-yl]-2,6-dimethoxybenzamide IUPAC Name: N-[5-(2-bromonaphthalen-1-yl)-1,3,4-thiadiazol-2-yl]-2,6-dimethoxybenzamide Traditional Name: N-[5-(2-bromo-1-naphthyl)-1,3,4-thiadiazol-2-yl]-2,6-dimethoxy-benzamide Formula: C21H16BrN3O3S MolecularWeight: 470.33904

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(=O)NC2=NN=C(S2)C3=C(C=CC4=CC=CC=C43)Br

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(=O)NC2=NN=C(S2)C3=C(C=CC4=CC=CC=C43)Br

InChI

InChI=1S/C21H16BrN3O3S/c1-27-15-8-5-9-16(28-2)18(15)19(26)23-21-25-24-20(29-21)17-13-7-4-3-6-12(13)10-11-14(17)22/h3-11H,1-2H3,(H,23,25,26)