1-[4-[4-(methylsulfonylmethyl)-6-morpholin-4-yl-pyrimidin-2-yl]phenyl]-3-propan-2-yl-urea

Systemtic Name: 1-[4-[4-(methylsulfonylmethyl)-6-morpholin-4-yl-pyrimidin-2-yl]phenyl]-3-propan-2-yl-urea Openeye Name: 1-isopropyl-3-[4-[4-(methylsulfonylmethyl)-6-morpholino-pyrimidin-2-yl]phenyl]urea CAS Name: 1-[4-[4-(methylsulfonylmethyl)-6-(4-morpholinyl)-2-pyrimidinyl]phenyl]-3-propan-2-ylurea IUPAC Name: 1-[4-[4-(methylsulfonylmethyl)-6-morpholin-4-ylpyrimidin-2-yl]phenyl]-3-propan-2-ylurea Traditional Name: 1-isopropyl-3-[4-[4-(mesylmethyl)-6-morpholino-pyrimidin-2-yl]phenyl]urea Formula: C20H27N5O4S MolecularWeight: 433.52448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1=CC=C(C=C1)C2=NC(=CC(=N2)N3CCOCC3)CS(=O)(=O)C

Isomeric SMILES

CC(C)NC(=O)NC1=CC=C(C=C1)C2=NC(=CC(=N2)N3CCOCC3)CS(=O)(=O)C

InChI

InChI=1S/C20H27N5O4S/c1-14(2)21-20(26)23-16-6-4-15(5-7-16)19-22-17(13-30(3,27)28)12-18(24-19)25-8-10-29-11-9-25/h4-7,12,14H,8-11,13H2,1-3H3,(H2,21,23,26)