4-(diethylsulfamoyl)-N-[2-(6-pyrrolidin-1-ylpyrimidin-4-yl)oxyethyl]benzamide

Systemtic Name: 4-(diethylsulfamoyl)-N-[2-(6-pyrrolidin-1-ylpyrimidin-4-yl)oxyethyl]benzamide Openeye Name: 4-(diethylsulfamoyl)-N-[2-(6-pyrrolidin-1-ylpyrimidin-4-yl)oxyethyl]benzamide CAS Name: 4-(diethylsulfamoyl)-N-[2-[[6-(1-pyrrolidinyl)-4-pyrimidinyl]oxy]ethyl]benzamide IUPAC Name: 4-(diethylsulfamoyl)-N-[2-(6-pyrrolidin-1-ylpyrimidin-4-yl)oxyethyl]benzamide Traditional Name: 4-(diethylsulfamoyl)-N-[2-(6-pyrrolidinopyrimidin-4-yl)oxyethyl]benzamide Formula: C21H29N5O4S MolecularWeight: 447.55106

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)NCCOC2=NC=NC(=C2)N3CCCC3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)NCCOC2=NC=NC(=C2)N3CCCC3

InChI

InChI=1S/C21H29N5O4S/c1-3-26(4-2)31(28,29)18-9-7-17(8-10-18)21(27)22-11-14-30-20-15-19(23-16-24-20)25-12-5-6-13-25/h7-10,15-16H,3-6,11-14H2,1-2H3,(H,22,27)