N-[3,4-bis(fluoranyl)phenyl]-3-(4-phenylpiperazin-1-yl)sulfonyl-thiophene-2-carboxamide

Systemtic Name: N-[3,4-bis(fluoranyl)phenyl]-3-(4-phenylpiperazin-1-yl)sulfonyl-thiophene-2-carboxamide Openeye Name: N-(3,4-difluorophenyl)-3-(4-phenylpiperazin-1-yl)sulfonyl-thiophene-2-carboxamide CAS Name: N-(3,4-difluorophenyl)-3-[(4-phenyl-1-piperazinyl)sulfonyl]-2-thiophenecarboxamide IUPAC Name: N-(3,4-difluorophenyl)-3-(4-phenylpiperazin-1-yl)sulfonylthiophene-2-carboxamide Traditional Name: N-(3,4-difluorophenyl)-3-(4-phenylpiperazino)sulfonyl-thiophene-2-carboxamide Formula: C21H19F2N3O3S2 MolecularWeight: 463.520666

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)S(=O)(=O)C3=C(SC=C3)C(=O)NC4=CC(=C(C=C4)F)F

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)S(=O)(=O)C3=C(SC=C3)C(=O)NC4=CC(=C(C=C4)F)F

InChI

InChI=1S/C21H19F2N3O3S2/c22-17-7-6-15(14-18(17)23)24-21(27)20-19(8-13-30-20)31(28,29)26-11-9-25(10-12-26)16-4-2-1-3-5-16/h1-8,13-14H,9-12H2,(H,24,27)