N-(3-chloranyl-2-methyl-phenyl)-2-fluoranyl-5-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]sulfonyl-benzamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-fluoranyl-5-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]sulfonyl-benzamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-2-fluoro-5-[3-methyl-4-(m-tolyl)piperazin-1-yl]sulfonyl-benzamide CAS Name: N-(3-chloro-2-methylphenyl)-2-fluoro-5-[[3-methyl-4-(3-methylphenyl)-1-piperazinyl]sulfonyl]benzamide IUPAC Name: N-(3-chloro-2-methylphenyl)-2-fluoro-5-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]sulfonylbenzamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-2-fluoro-5-[3-methyl-4-(m-tolyl)piperazino]sulfonyl-benzamide Formula: C26H27ClFN3O3S MolecularWeight: 516.027283

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=CC(=C2)C)S(=O)(=O)C3=CC(=C(C=C3)F)C(=O)NC4=C(C(=CC=C4)Cl)C

Isomeric SMILES

CC1CN(CCN1C2=CC=CC(=C2)C)S(=O)(=O)C3=CC(=C(C=C3)F)C(=O)NC4=C(C(=CC=C4)Cl)C

InChI

InChI=1S/C26H27ClFN3O3S/c1-17-6-4-7-20(14-17)31-13-12-30(16-18(31)2)35(33,34)21-10-11-24(28)22(15-21)26(32)29-25-9-5-8-23(27)19(25)3/h4-11,14-15,18H,12-13,16H2,1-3H3,(H,29,32)