N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylethyl]-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylethyl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylethyl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[2-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]ethyl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylethyl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2-[4-(2-pyrimidyl)piperazino]sulfonylethyl]-4-pyrrolidinosulfonyl-benzamide Formula: C21H28N6O5S2 MolecularWeight: 508.61422

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCS(=O)(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCS(=O)(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C21H28N6O5S2/c28-20(18-4-6-19(7-5-18)34(31,32)27-11-1-2-12-27)22-10-17-33(29,30)26-15-13-25(14-16-26)21-23-8-3-9-24-21/h3-9H,1-2,10-17H2,(H,22,28)