4-[[(3-acetamido-3-thiophen-2-yl-propanoyl)-methyl-amino]methyl]benzamide

Systemtic Name: 4-[[(3-acetamido-3-thiophen-2-yl-propanoyl)-methyl-amino]methyl]benzamide Openeye Name: 4-[[[3-acetamido-3-(2-thienyl)propanoyl]-methyl-amino]methyl]benzamide CAS Name: 4-[[(3-acetamido-1-oxo-3-thiophen-2-ylpropyl)-methylamino]methyl]benzamide IUPAC Name: 4-[[(3-acetamido-3-thiophen-2-ylpropanoyl)-methylamino]methyl]benzamide Traditional Name: 4-[[[3-acetamido-3-(2-thienyl)propanoyl]-methyl-amino]methyl]benzamide Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)N(C)CC1=CC=C(C=C1)C(=O)N)C2=CC=CS2

Isomeric SMILES

CC(=O)NC(CC(=O)N(C)CC1=CC=C(C=C1)C(=O)N)C2=CC=CS2

InChI

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