5-chloranyl-2-[2-[4-[(4-fluorophenyl)methyl]-2-methyl-piperazin-1-yl]-2-oxidanylidene-ethoxy]-N-methylsulfonyl-benzamide

Systemtic Name: 5-chloranyl-2-[2-[4-[(4-fluorophenyl)methyl]-2-methyl-piperazin-1-yl]-2-oxidanylidene-ethoxy]-N-methylsulfonyl-benzamide Openeye Name: 5-chloro-2-[2-[4-[(4-fluorophenyl)methyl]-2-methyl-piperazin-1-yl]-2-oxo-ethoxy]-N-methylsulfonyl-benzamide CAS Name: 5-chloro-2-[2-[4-[(4-fluorophenyl)methyl]-2-methyl-1-piperazinyl]-2-oxoethoxy]-N-methylsulfonylbenzamide IUPAC Name: 5-chloro-2-[2-[4-[(4-fluorophenyl)methyl]-2-methylpiperazin-1-yl]-2-oxoethoxy]-N-methylsulfonylbenzamide Traditional Name: 5-chloro-2-[2-[4-(4-fluorobenzyl)-2-methyl-piperazino]-2-keto-ethoxy]-N-mesyl-benzamide Formula: C22H25ClFN3O5S MolecularWeight: 497.967403

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)COC2=C(C=C(C=C2)Cl)C(=O)NS(=O)(=O)C)CC3=CC=C(C=C3)F

Isomeric SMILES

CC1CN(CCN1C(=O)COC2=C(C=C(C=C2)Cl)C(=O)NS(=O)(=O)C)CC3=CC=C(C=C3)F

InChI

InChI=1S/C22H25ClFN3O5S/c1-15-12-26(13-16-3-6-18(24)7-4-16)9-10-27(15)21(28)14-32-20-8-5-17(23)11-19(20)22(29)25-33(2,30)31/h3-8,11,15H,9-10,12-14H2,1-2H3,(H,25,29)