3-[3-oxidanylidene-3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-2-one

Systemtic Name: 3-[3-oxidanylidene-3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-2-one Openeye Name: 3-[3-oxo-3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-2-one CAS Name: 3-[3-oxo-3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]-6-(1-pyrrolidinylsulfonyl)-1,3-benzoxazol-2-one IUPAC Name: 3-[3-oxo-3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-2-one Traditional Name: 3-[3-keto-3-[4-(2-pyrimidyl)piperazino]propyl]-6-pyrrolidinosulfonyl-1,3-benzoxazol-2-one Formula: C22H26N6O5S MolecularWeight: 486.54404

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)CCC(=O)N4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)CCC(=O)N4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C22H26N6O5S/c29-20(25-12-14-26(15-13-25)21-23-7-3-8-24-21)6-11-28-18-5-4-17(16-19(18)33-22(28)30)34(31,32)27-9-1-2-10-27/h3-5,7-8,16H,1-2,6,9-15H2