N-[[2-(dimethylamino)-5-(propanoylamino)phenyl]methyl]-N-(furan-2-ylmethyl)thiophene-2-carboxamide

Systemtic Name: N-[[2-(dimethylamino)-5-(propanoylamino)phenyl]methyl]-N-(furan-2-ylmethyl)thiophene-2-carboxamide Openeye Name: N-[[2-(dimethylamino)-5-(propanoylamino)phenyl]methyl]-N-(2-furylmethyl)thiophene-2-carboxamide CAS Name: N-[[2-(dimethylamino)-5-(1-oxopropylamino)phenyl]methyl]-N-(2-furanylmethyl)-2-thiophenecarboxamide IUPAC Name: N-[[2-(dimethylamino)-5-(propanoylamino)phenyl]methyl]-N-(furan-2-ylmethyl)thiophene-2-carboxamide Traditional Name: N-[2-(dimethylamino)-5-propionamido-benzyl]-N-(2-furfuryl)thiophene-2-carboxamide Formula: C22H25N3O3S MolecularWeight: 411.5172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=C(C=C1)N(C)C)CN(CC2=CC=CO2)C(=O)C3=CC=CS3

Isomeric SMILES

CCC(=O)NC1=CC(=C(C=C1)N(C)C)CN(CC2=CC=CO2)C(=O)C3=CC=CS3

InChI

InChI=1S/C22H25N3O3S/c1-4-21(26)23-17-9-10-19(24(2)3)16(13-17)14-25(15-18-7-5-11-28-18)22(27)20-8-6-12-29-20/h5-13H,4,14-15H2,1-3H3,(H,23,26)