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

Systemtic Name: N-[3-(3,4-dimethoxyphenyl)-1,2,4-thiadiazol-5-yl]-4-(2-methylpropoxy)benzamide Openeye Name: N-[3-(3,4-dimethoxyphenyl)-1,2,4-thiadiazol-5-yl]-4-isobutoxy-benzamide CAS Name: N-[3-(3,4-dimethoxyphenyl)-1,2,4-thiadiazol-5-yl]-4-(2-methylpropoxy)benzamide IUPAC Name: N-[3-(3,4-dimethoxyphenyl)-1,2,4-thiadiazol-5-yl]-4-(2-methylpropoxy)benzamide Traditional Name: N-[3-(3,4-dimethoxyphenyl)-1,2,4-thiadiazol-5-yl]-4-isobutoxy-benzamide Formula: C21H23N3O4S MolecularWeight: 413.49002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)C(=O)NC2=NC(=NS2)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)C(=O)NC2=NC(=NS2)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H23N3O4S/c1-13(2)12-28-16-8-5-14(6-9-16)20(25)23-21-22-19(24-29-21)15-7-10-17(26-3)18(11-15)27-4/h5-11,13H,12H2,1-4H3,(H,22,23,24,25)