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

Systemtic Name: N-cycloheptyl-3-[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl-thiophene-2-carboxamide Openeye Name: N-cycloheptyl-3-[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl-thiophene-2-carboxamide CAS Name: N-cycloheptyl-3-[[4-(2-fluorophenyl)-1-piperazinyl]sulfonyl]-2-thiophenecarboxamide IUPAC Name: N-cycloheptyl-3-[4-(2-fluorophenyl)piperazin-1-yl]sulfonylthiophene-2-carboxamide Traditional Name: N-cycloheptyl-3-[4-(2-fluorophenyl)piperazino]sulfonyl-thiophene-2-carboxamide Formula: C22H28FN3O3S2 MolecularWeight: 465.604423

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)C2=C(C=CS2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

C1CCCC(CC1)NC(=O)C2=C(C=CS2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4F

InChI

InChI=1S/C22H28FN3O3S2/c23-18-9-5-6-10-19(18)25-12-14-26(15-13-25)31(28,29)20-11-16-30-21(20)22(27)24-17-7-3-1-2-4-8-17/h5-6,9-11,16-17H,1-4,7-8,12-15H2,(H,24,27)