(2R)-2-(6-azanyl-3,5-dicyano-pyridin-2-yl)sulfanyl-N-(4-morpholin-4-ylphenyl)propanamide

Systemtic Name: (2R)-2-(6-azanyl-3,5-dicyano-pyridin-2-yl)sulfanyl-N-(4-morpholin-4-ylphenyl)propanamide Openeye Name: (2R)-2-[(6-amino-3,5-dicyano-2-pyridyl)sulfanyl]-N-(4-morpholinophenyl)propanamide CAS Name: (2R)-2-[(6-amino-3,5-dicyano-2-pyridinyl)thio]-N-[4-(4-morpholinyl)phenyl]propanamide IUPAC Name: (2R)-2-(6-amino-3,5-dicyanopyridin-2-yl)sulfanyl-N-(4-morpholin-4-ylphenyl)propanamide Traditional Name: (2R)-2-[(6-amino-3,5-dicyano-2-pyridyl)thio]-N-(4-morpholinophenyl)propionamide Formula: C20H20N6O2S MolecularWeight: 408.4768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N2CCOCC2)SC3=C(C=C(C(=N3)N)C#N)C#N

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)N2CCOCC2)SC3=C(C=C(C(=N3)N)C#N)C#N

InChI

InChI=1S/C20H20N6O2S/c1-13(29-20-15(12-22)10-14(11-21)18(23)25-20)19(27)24-16-2-4-17(5-3-16)26-6-8-28-9-7-26/h2-5,10,13H,6-9H2,1H3,(H2,23,25)(H,24,27)/t13-/m1/s1