3-[(phenylmethyl)-[2-(1-propylimidazol-2-yl)sulfanylethanoyl]amino]propanamide

Systemtic Name: 3-[(phenylmethyl)-[2-(1-propylimidazol-2-yl)sulfanylethanoyl]amino]propanamide Openeye Name: 3-[benzyl-[2-(1-propylimidazol-2-yl)sulfanylacetyl]amino]propanamide CAS Name: 3-[[1-oxo-2-[(1-propyl-2-imidazolyl)thio]ethyl]-(phenylmethyl)amino]propanamide IUPAC Name: 3-[benzyl-[2-(1-propylimidazol-2-yl)sulfanylacetyl]amino]propanamide Traditional Name: 3-[benzyl-[2-[(1-propylimidazol-2-yl)thio]acetyl]amino]propionamide Formula: C18H24N4O2S MolecularWeight: 360.47376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=CN=C1SCC(=O)N(CCC(=O)N)CC2=CC=CC=C2

Isomeric SMILES

CCCN1C=CN=C1SCC(=O)N(CCC(=O)N)CC2=CC=CC=C2

InChI

InChI=1S/C18H24N4O2S/c1-2-10-21-12-9-20-18(21)25-14-17(24)22(11-8-16(19)23)13-15-6-4-3-5-7-15/h3-7,9,12H,2,8,10-11,13-14H2,1H3,(H2,19,23)