N-(2-azanylethyl)-1-(5-chloranylthiophen-2-yl)sulfonyl-4-(4-fluorophenyl)sulfonyl-piperazine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-(5-chloranylthiophen-2-yl)sulfonyl-4-(4-fluorophenyl)sulfonyl-piperazine-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-[(5-chloro-2-thienyl)sulfonyl]-4-(4-fluorophenyl)sulfonyl-piperazine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-[(5-chloro-2-thiophenyl)sulfonyl]-4-(4-fluorophenyl)sulfonyl-2-piperazinecarboxamide IUPAC Name: N-(2-aminoethyl)-1-(5-chlorothiophen-2-yl)sulfonyl-4-(4-fluorophenyl)sulfonylpiperazine-2-carboxamide Traditional Name: N-(2-aminoethyl)-1-[(5-chloro-2-thienyl)sulfonyl]-4-(4-fluorophenyl)sulfonyl-piperazine-2-carboxamide Formula: C17H20ClFN4O5S3 MolecularWeight: 511.010903

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NCCN)S(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

C1CN(C(CN1S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NCCN)S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C17H20ClFN4O5S3/c18-15-5-6-16(29-15)31(27,28)23-10-9-22(11-14(23)17(24)21-8-7-20)30(25,26)13-3-1-12(19)2-4-13/h1-6,14H,7-11,20H2,(H,21,24)