2-azanyl-4-chloranyl-N-[2-[4-(4-fluoranyl-2-methylsulfonyl-phenyl)piperazin-1-yl]-2-oxidanylidene-1-phenyl-ethyl]benzamide

Systemtic Name: 2-azanyl-4-chloranyl-N-[2-[4-(4-fluoranyl-2-methylsulfonyl-phenyl)piperazin-1-yl]-2-oxidanylidene-1-phenyl-ethyl]benzamide Openeye Name: 2-amino-4-chloro-N-[2-[4-(4-fluoro-2-methylsulfonyl-phenyl)piperazin-1-yl]-2-oxo-1-phenyl-ethyl]benzamide CAS Name: 2-amino-4-chloro-N-[2-[4-(4-fluoro-2-methylsulfonylphenyl)-1-piperazinyl]-2-oxo-1-phenylethyl]benzamide IUPAC Name: 2-amino-4-chloro-N-[2-[4-(4-fluoro-2-methylsulfonylphenyl)piperazin-1-yl]-2-oxo-1-phenylethyl]benzamide Traditional Name: 2-amino-4-chloro-N-[2-[4-(4-fluoro-2-mesyl-phenyl)piperazino]-2-keto-1-phenyl-ethyl]benzamide Formula: C26H26ClFN4O4S MolecularWeight: 545.025443

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)F)N2CCN(CC2)C(=O)C(C3=CC=CC=C3)NC(=O)C4=C(C=C(C=C4)Cl)N

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)F)N2CCN(CC2)C(=O)C(C3=CC=CC=C3)NC(=O)C4=C(C=C(C=C4)Cl)N

InChI

InChI=1S/C26H26ClFN4O4S/c1-37(35,36)23-16-19(28)8-10-22(23)31-11-13-32(14-12-31)26(34)24(17-5-3-2-4-6-17)30-25(33)20-9-7-18(27)15-21(20)29/h2-10,15-16,24H,11-14,29H2,1H3,(H,30,33)