3-[[4-(3-morpholin-4-ylpropylamino)pyrimidin-2-yl]amino]-N-phenyl-benzenesulfonamide

Systemtic Name: 3-[[4-(3-morpholin-4-ylpropylamino)pyrimidin-2-yl]amino]-N-phenyl-benzenesulfonamide Openeye Name: 3-[[4-(3-morpholinopropylamino)pyrimidin-2-yl]amino]-N-phenyl-benzenesulfonamide CAS Name: 3-[[4-[3-(4-morpholinyl)propylamino]-2-pyrimidinyl]amino]-N-phenylbenzenesulfonamide IUPAC Name: 3-[[4-(3-morpholin-4-ylpropylamino)pyrimidin-2-yl]amino]-N-phenylbenzenesulfonamide Traditional Name: 3-[[4-(3-morpholinopropylamino)pyrimidin-2-yl]amino]-N-phenyl-benzenesulfonamide Formula: C23H28N6O3S MolecularWeight: 468.57182

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC2=NC(=NC=C2)NC3=CC(=CC=C3)S(=O)(=O)NC4=CC=CC=C4

Isomeric SMILES

C1COCCN1CCCNC2=NC(=NC=C2)NC3=CC(=CC=C3)S(=O)(=O)NC4=CC=CC=C4

InChI

InChI=1S/C23H28N6O3S/c30-33(31,28-19-6-2-1-3-7-19)21-9-4-8-20(18-21)26-23-25-12-10-22(27-23)24-11-5-13-29-14-16-32-17-15-29/h1-4,6-10,12,18,28H,5,11,13-17H2,(H2,24,25,26,27)