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

Systemtic Name: N-[3-[[4-(3-morpholin-4-ylpropylamino)pyrimidin-2-yl]amino]phenyl]benzenesulfonamide Openeye Name: N-[3-[[4-(3-morpholinopropylamino)pyrimidin-2-yl]amino]phenyl]benzenesulfonamide CAS Name: N-[3-[[4-[3-(4-morpholinyl)propylamino]-2-pyrimidinyl]amino]phenyl]benzenesulfonamide IUPAC Name: N-[3-[[4-(3-morpholin-4-ylpropylamino)pyrimidin-2-yl]amino]phenyl]benzenesulfonamide Traditional Name: N-[3-[[4-(3-morpholinopropylamino)pyrimidin-2-yl]amino]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)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1COCCN1CCCNC2=NC(=NC=C2)NC3=CC(=CC=C3)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H28N6O3S/c30-33(31,21-8-2-1-3-9-21)28-20-7-4-6-19(18-20)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)