N'-(2-ethyl-6-methyl-phenyl)-N-(2-morpholin-4-yl-2-thiophen-3-yl-ethyl)ethanediamide

Systemtic Name: N'-(2-ethyl-6-methyl-phenyl)-N-(2-morpholin-4-yl-2-thiophen-3-yl-ethyl)ethanediamide Openeye Name: N'-(2-ethyl-6-methyl-phenyl)-N-[2-morpholino-2-(3-thienyl)ethyl]oxamide CAS Name: N'-(2-ethyl-6-methylphenyl)-N-[2-(4-morpholinyl)-2-(3-thiophenyl)ethyl]oxamide IUPAC Name: N'-(2-ethyl-6-methylphenyl)-N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)oxamide Traditional Name: N'-(2-ethyl-6-methyl-phenyl)-N-[2-morpholino-2-(3-thienyl)ethyl]oxamide Formula: C21H27N3O3S MolecularWeight: 401.52238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C(=O)NCC(C2=CSC=C2)N3CCOCC3)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C(=O)NCC(C2=CSC=C2)N3CCOCC3)C

InChI

InChI=1S/C21H27N3O3S/c1-3-16-6-4-5-15(2)19(16)23-21(26)20(25)22-13-18(17-7-12-28-14-17)24-8-10-27-11-9-24/h4-7,12,14,18H,3,8-11,13H2,1-2H3,(H,22,25)(H,23,26)