4-benzamido-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)benzamide

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NN=C(S1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCC(CC)C1=NN=C(S1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22N4O2S/c1-3-14(4-2)20-24-25-21(28-20)23-19(27)16-10-12-17(13-11-16)22-18(26)15-8-6-5-7-9-15/h5-14H,3-4H2,1-2H3,(H,22,26)(H,23,25,27)