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

Systemtic Name: N-[(4-ethylphenyl)methyl]-3-[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl-thiophene-2-carboxamide Openeye Name: N-[(4-ethylphenyl)methyl]-3-[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl-thiophene-2-carboxamide CAS Name: N-[(4-ethylphenyl)methyl]-3-[[4-(2-fluorophenyl)-1-piperazinyl]sulfonyl]-2-thiophenecarboxamide IUPAC Name: N-[(4-ethylphenyl)methyl]-3-[4-(2-fluorophenyl)piperazin-1-yl]sulfonylthiophene-2-carboxamide Traditional Name: N-(4-ethylbenzyl)-3-[4-(2-fluorophenyl)piperazino]sulfonyl-thiophene-2-carboxamide Formula: C24H26FN3O3S2 MolecularWeight: 487.609943

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CNC(=O)C2=C(C=CS2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

CCC1=CC=C(C=C1)CNC(=O)C2=C(C=CS2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4F

InChI

InChI=1S/C24H26FN3O3S2/c1-2-18-7-9-19(10-8-18)17-26-24(29)23-22(11-16-32-23)33(30,31)28-14-12-27(13-15-28)21-6-4-3-5-20(21)25/h3-11,16H,2,12-15,17H2,1H3,(H,26,29)