N-tert-butyl-4-chloranyl-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-benzamide

Systemtic Name: N-tert-butyl-4-chloranyl-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-benzamide Openeye Name: N-tert-butyl-4-chloro-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-benzamide CAS Name: N-tert-butyl-4-chloro-3-[[4-(4-fluorophenyl)-1-piperazinyl]sulfonyl]benzamide IUPAC Name: N-tert-butyl-4-chloro-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylbenzamide Traditional Name: N-tert-butyl-4-chloro-3-[4-(4-fluorophenyl)piperazino]sulfonyl-benzamide Formula: C21H25ClFN3O3S MolecularWeight: 453.957903

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H25ClFN3O3S/c1-21(2,3)24-20(27)15-4-9-18(22)19(14-15)30(28,29)26-12-10-25(11-13-26)17-7-5-16(23)6-8-17/h4-9,14H,10-13H2,1-3H3,(H,24,27)