N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylpropyl]-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylpropyl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylpropyl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[3-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]propyl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylpropyl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[3-[4-(2-pyrimidyl)piperazino]sulfonylpropyl]-4-pyrrolidinosulfonyl-benzamide Formula: C22H30N6O5S2 MolecularWeight: 522.6408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30N6O5S2/c29-21(19-5-7-20(8-6-19)35(32,33)28-12-1-2-13-28)23-11-4-18-34(30,31)27-16-14-26(15-17-27)22-24-9-3-10-25-22/h3,5-10H,1-2,4,11-18H2,(H,23,29)