3-benzamido-N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 3-benzamido-N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 3-benzamido-N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 3-benzamido-N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 3-benzamido-N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 3-benzamido-N-(5-neopentyl-1,3,4-thiadiazol-2-yl)benzamide Formula: C21H22N4O2S MolecularWeight: 394.48998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC1=NN=C(S1)NC(=O)C2=CC(=CC=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)CC1=NN=C(S1)NC(=O)C2=CC(=CC=C2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22N4O2S/c1-21(2,3)13-17-24-25-20(28-17)23-19(27)15-10-7-11-16(12-15)22-18(26)14-8-5-4-6-9-14/h4-12H,13H2,1-3H3,(H,22,26)(H,23,25,27)