3-[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl-N-(3-methylphenyl)thiophene-2-carboxamide

Systemtic Name: 3-[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl-N-(3-methylphenyl)thiophene-2-carboxamide Openeye Name: 3-[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl-N-(m-tolyl)thiophene-2-carboxamide CAS Name: 3-[[4-(2-fluorophenyl)-1-piperazinyl]sulfonyl]-N-(3-methylphenyl)-2-thiophenecarboxamide IUPAC Name: 3-[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl-N-(3-methylphenyl)thiophene-2-carboxamide Traditional Name: 3-[4-(2-fluorophenyl)piperazino]sulfonyl-N-(m-tolyl)thiophene-2-carboxamide Formula: C22H22FN3O3S2 MolecularWeight: 459.556783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C2=C(C=CS2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C2=C(C=CS2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4F

InChI

InChI=1S/C22H22FN3O3S2/c1-16-5-4-6-17(15-16)24-22(27)21-20(9-14-30-21)31(28,29)26-12-10-25(11-13-26)19-8-3-2-7-18(19)23/h2-9,14-15H,10-13H2,1H3,(H,24,27)