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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2F)S(=O)(=O)C3=C(SC=C3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2F)S(=O)(=O)C3=C(SC=C3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C22H22FN3O3S2/c23-18-8-4-5-9-19(18)25-11-13-26(14-12-25)31(28,29)20-10-15-30-21(20)22(27)24-16-17-6-2-1-3-7-17/h1-10,15H,11-14,16H2,(H,24,27)