(2S)-2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanyl-N-(2-propan-2-ylpyrazol-3-yl)propanamide

Systemtic Name: (2S)-2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanyl-N-(2-propan-2-ylpyrazol-3-yl)propanamide Openeye Name: (2S)-N-(2-isopropylpyrazol-3-yl)-2-[(5-morpholinosulfonyl-2-pyridyl)sulfanyl]propanamide CAS Name: (2S)-2-[[5-(4-morpholinylsulfonyl)-2-pyridinyl]thio]-N-(2-propan-2-yl-3-pyrazolyl)propanamide IUPAC Name: (2S)-2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanyl-N-(2-propan-2-ylpyrazol-3-yl)propanamide Traditional Name: (2S)-N-(2-isopropylpyrazol-3-yl)-2-[(5-morpholinosulfonyl-2-pyridyl)thio]propionamide Formula: C18H25N5O4S2 MolecularWeight: 439.5522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=CC=N1)NC(=O)C(C)SC2=NC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=NN1C(C)C)SC2=NC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H25N5O4S2/c1-13(2)23-16(6-7-20-23)21-18(24)14(3)28-17-5-4-15(12-19-17)29(25,26)22-8-10-27-11-9-22/h4-7,12-14H,8-11H2,1-3H3,(H,21,24)/t14-/m0/s1