4-chloranyl-N-[[5-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylthiophen-2-yl]methyl]benzamide

Systemtic Name: 4-chloranyl-N-[[5-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylthiophen-2-yl]methyl]benzamide Openeye Name: 4-chloro-N-[[5-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonyl-2-thienyl]methyl]benzamide CAS Name: 4-chloro-N-[[5-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]-2-thiophenyl]methyl]benzamide IUPAC Name: 4-chloro-N-[[5-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylthiophen-2-yl]methyl]benzamide Traditional Name: 4-chloro-N-[[5-[4-(2-pyrimidyl)piperazino]sulfonyl-2-thienyl]methyl]benzamide Formula: C20H20ClN5O3S2 MolecularWeight: 477.9875

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)S(=O)(=O)C3=CC=C(S3)CNC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)S(=O)(=O)C3=CC=C(S3)CNC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H20ClN5O3S2/c21-16-4-2-15(3-5-16)19(27)24-14-17-6-7-18(30-17)31(28,29)26-12-10-25(11-13-26)20-22-8-1-9-23-20/h1-9H,10-14H2,(H,24,27)