3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-N-(2-methyl-6-propan-2-yl-phenyl)benzamide

Systemtic Name: 3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-N-(2-methyl-6-propan-2-yl-phenyl)benzamide Openeye Name: 3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-N-(2-isopropyl-6-methyl-phenyl)benzamide CAS Name: 3-[[4-(4-fluorophenyl)-1-piperazinyl]sulfonyl]-N-(2-methyl-6-propan-2-ylphenyl)benzamide IUPAC Name: 3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-N-(2-methyl-6-propan-2-ylphenyl)benzamide Traditional Name: 3-[4-(4-fluorophenyl)piperazino]sulfonyl-N-(2-isopropyl-6-methyl-phenyl)benzamide Formula: C27H30FN3O3S MolecularWeight: 495.608803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C27H30FN3O3S/c1-19(2)25-9-4-6-20(3)26(25)29-27(32)21-7-5-8-24(18-21)35(33,34)31-16-14-30(15-17-31)23-12-10-22(28)11-13-23/h4-13,18-19H,14-17H2,1-3H3,(H,29,32)