N-[4-[4-(methylsulfonylmethyl)-6-morpholin-4-yl-pyrimidin-2-yl]phenyl]butane-1-sulfonamide

Systemtic Name: N-[4-[4-(methylsulfonylmethyl)-6-morpholin-4-yl-pyrimidin-2-yl]phenyl]butane-1-sulfonamide Openeye Name: N-[4-[4-(methylsulfonylmethyl)-6-morpholino-pyrimidin-2-yl]phenyl]butane-1-sulfonamide CAS Name: N-[4-[4-(methylsulfonylmethyl)-6-(4-morpholinyl)-2-pyrimidinyl]phenyl]-1-butanesulfonamide IUPAC Name: N-[4-[4-(methylsulfonylmethyl)-6-morpholin-4-ylpyrimidin-2-yl]phenyl]butane-1-sulfonamide Traditional Name: N-[4-[4-(mesylmethyl)-6-morpholino-pyrimidin-2-yl]phenyl]butane-1-sulfonamide Formula: C20H28N4O5S2 MolecularWeight: 468.59012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28N4O5S2/c1-3-4-13-31(27,28)23-17-7-5-16(6-8-17)20-21-18(15-30(2,25)26)14-19(22-20)24-9-11-29-12-10-24/h5-8,14,23H,3-4,9-13,15H2,1-2H3