N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide

Systemtic Name: N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide Openeye Name: N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide CAS Name: N-[5-(dimethylsulfamoyl)-2-methylphenyl]-2-[4-(2-pyrimidinyl)-1-piperazinyl]propanamide IUPAC Name: N-[5-(dimethylsulfamoyl)-2-methylphenyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide Traditional Name: N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-2-[4-(2-pyrimidyl)piperazino]propionamide Formula: C20H28N6O3S MolecularWeight: 432.53972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=O)C(C)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=O)C(C)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C20H28N6O3S/c1-15-6-7-17(30(28,29)24(3)4)14-18(15)23-19(27)16(2)25-10-12-26(13-11-25)20-21-8-5-9-22-20/h5-9,14,16H,10-13H2,1-4H3,(H,23,27)