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

Systemtic Name: N-[(2-chlorophenyl)methyl]-3-[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl-thiophene-2-carboxamide Openeye Name: N-[(2-chlorophenyl)methyl]-3-[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl-thiophene-2-carboxamide CAS Name: N-[(2-chlorophenyl)methyl]-3-[[4-(2-fluorophenyl)-1-piperazinyl]sulfonyl]-2-thiophenecarboxamide IUPAC Name: N-[(2-chlorophenyl)methyl]-3-[4-(2-fluorophenyl)piperazin-1-yl]sulfonylthiophene-2-carboxamide Traditional Name: N-(2-chlorobenzyl)-3-[4-(2-fluorophenyl)piperazino]sulfonyl-thiophene-2-carboxamide Formula: C22H21ClFN3O3S2 MolecularWeight: 494.001843

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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=C4Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2F)S(=O)(=O)C3=C(SC=C3)C(=O)NCC4=CC=CC=C4Cl

InChI

InChI=1S/C22H21ClFN3O3S2/c23-17-6-2-1-5-16(17)15-25-22(28)21-20(9-14-31-21)32(29,30)27-12-10-26(11-13-27)19-8-4-3-7-18(19)24/h1-9,14H,10-13,15H2,(H,25,28)