3-[[(3-acetamido-3-thiophen-2-yl-propanoyl)amino]methyl]-N-methyl-benzamide

Systemtic Name: 3-[[(3-acetamido-3-thiophen-2-yl-propanoyl)amino]methyl]-N-methyl-benzamide Openeye Name: 3-[[[3-acetamido-3-(2-thienyl)propanoyl]amino]methyl]-N-methyl-benzamide CAS Name: 3-[[(3-acetamido-1-oxo-3-thiophen-2-ylpropyl)amino]methyl]-N-methylbenzamide IUPAC Name: 3-[[(3-acetamido-3-thiophen-2-ylpropanoyl)amino]methyl]-N-methylbenzamide Traditional Name: 3-[[[3-acetamido-3-(2-thienyl)propanoyl]amino]methyl]-N-methyl-benzamide Formula: C18H21N3O3S MolecularWeight: 359.44264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)NCC1=CC=CC(=C1)C(=O)NC)C2=CC=CS2

Isomeric SMILES

CC(=O)NC(CC(=O)NCC1=CC=CC(=C1)C(=O)NC)C2=CC=CS2

InChI

InChI=1S/C18H21N3O3S/c1-12(22)21-15(16-7-4-8-25-16)10-17(23)20-11-13-5-3-6-14(9-13)18(24)19-2/h3-9,15H,10-11H2,1-2H3,(H,19,24)(H,20,23)(H,21,22)