N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-(3-phenylpropanoylamino)butanamide

Systemtic Name: N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-(3-phenylpropanoylamino)butanamide Openeye Name: N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-(3-phenylpropanoylamino)butanamide CAS Name: N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-[(1-oxo-3-phenylpropyl)amino]butanamide IUPAC Name: N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-(3-phenylpropanoylamino)butanamide Traditional Name: 2-(hydrocinnamoylamino)-N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-butyramide Formula: C23H26N4O3S MolecularWeight: 438.54254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=NN=C(S1)C2=CC(=CC=C2)OC)NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

CC(C)C(C(=O)NC1=NN=C(S1)C2=CC(=CC=C2)OC)NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C23H26N4O3S/c1-15(2)20(24-19(28)13-12-16-8-5-4-6-9-16)21(29)25-23-27-26-22(31-23)17-10-7-11-18(14-17)30-3/h4-11,14-15,20H,12-13H2,1-3H3,(H,24,28)(H,25,27,29)