3-(5-cyano-2,4-dimethyl-6-oxidanylidene-1H-pyridin-3-yl)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-yl-ethyl]propanamide

Systemtic Name: 3-(5-cyano-2,4-dimethyl-6-oxidanylidene-1H-pyridin-3-yl)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-yl-ethyl]propanamide Openeye Name: 3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)-N-[(2S)-2-morpholino-2-(2-thienyl)ethyl]propanamide CAS Name: 3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)-N-[(2S)-2-(4-morpholinyl)-2-thiophen-2-ylethyl]propanamide IUPAC Name: 3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]propanamide Traditional Name: 3-(5-cyano-6-keto-2,4-dimethyl-1H-pyridin-3-yl)-N-[(2S)-2-morpholino-2-(2-thienyl)ethyl]propionamide Formula: C21H26N4O3S MolecularWeight: 414.52114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=C1CCC(=O)NCC(C2=CC=CS2)N3CCOCC3)C)C#N

Isomeric SMILES

CC1=C(C(=O)NC(=C1CCC(=O)NC[C@@H](C2=CC=CS2)N3CCOCC3)C)C#N

InChI

InChI=1S/C21H26N4O3S/c1-14-16(15(2)24-21(27)17(14)12-22)5-6-20(26)23-13-18(19-4-3-11-29-19)25-7-9-28-10-8-25/h3-4,11,18H,5-10,13H2,1-2H3,(H,23,26)(H,24,27)/t18-/m0/s1