N-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamide

Systemtic Name: N-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamide Openeye Name: N-(2-chloro-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide CAS Name: N-[2-chloro-5-(1-pyrrolidinylsulfonyl)phenyl]-2-[4-(2-pyrimidinyl)-1-piperazinyl]acetamide IUPAC Name: N-(2-chloro-5-pyrrolidin-1-ylsulfonylphenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide Traditional Name: N-(2-chloro-5-pyrrolidinosulfonyl-phenyl)-2-[4-(2-pyrimidyl)piperazino]acetamide Formula: C20H25ClN6O3S MolecularWeight: 464.9689

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)CN3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)CN3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C20H25ClN6O3S/c21-17-5-4-16(31(29,30)27-8-1-2-9-27)14-18(17)24-19(28)15-25-10-12-26(13-11-25)20-22-6-3-7-23-20/h3-7,14H,1-2,8-13,15H2,(H,24,28)