4-[[4-(3,4-dimethoxyphenyl)pyrimidin-2-yl]amino]-N-(3-morpholin-4-ylpropyl)benzenesulfonamide

Systemtic Name: 4-[[4-(3,4-dimethoxyphenyl)pyrimidin-2-yl]amino]-N-(3-morpholin-4-ylpropyl)benzenesulfonamide Openeye Name: 4-[[4-(3,4-dimethoxyphenyl)pyrimidin-2-yl]amino]-N-(3-morpholinopropyl)benzenesulfonamide CAS Name: 4-[[4-(3,4-dimethoxyphenyl)-2-pyrimidinyl]amino]-N-[3-(4-morpholinyl)propyl]benzenesulfonamide IUPAC Name: 4-[[4-(3,4-dimethoxyphenyl)pyrimidin-2-yl]amino]-N-(3-morpholin-4-ylpropyl)benzenesulfonamide Traditional Name: 4-[[4-(3,4-dimethoxyphenyl)pyrimidin-2-yl]amino]-N-(3-morpholinopropyl)benzenesulfonamide Formula: C25H31N5O5S MolecularWeight: 513.60914

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=NC=C2)NC3=CC=C(C=C3)S(=O)(=O)NCCCN4CCOCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=NC=C2)NC3=CC=C(C=C3)S(=O)(=O)NCCCN4CCOCC4)OC

InChI

InChI=1S/C25H31N5O5S/c1-33-23-9-4-19(18-24(23)34-2)22-10-12-26-25(29-22)28-20-5-7-21(8-6-20)36(31,32)27-11-3-13-30-14-16-35-17-15-30/h4-10,12,18,27H,3,11,13-17H2,1-2H3,(H,26,28,29)