N-(4-fluorophenyl)-4-[2-(4-nitrophenyl)sulfanylethanoyl]piperazine-1-carboxamide

Systemtic Name: N-(4-fluorophenyl)-4-[2-(4-nitrophenyl)sulfanylethanoyl]piperazine-1-carboxamide Openeye Name: N-(4-fluorophenyl)-4-[2-(4-nitrophenyl)sulfanylacetyl]piperazine-1-carboxamide CAS Name: N-(4-fluorophenyl)-4-[2-[(4-nitrophenyl)thio]-1-oxoethyl]-1-piperazinecarboxamide IUPAC Name: N-(4-fluorophenyl)-4-[2-(4-nitrophenyl)sulfanylacetyl]piperazine-1-carboxamide Traditional Name: N-(4-fluorophenyl)-4-[2-[(4-nitrophenyl)thio]acetyl]piperazine-1-carboxamide Formula: C19H19FN4O4S MolecularWeight: 418.441963

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CSC2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCN1C(=O)CSC2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C19H19FN4O4S/c20-14-1-3-15(4-2-14)21-19(26)23-11-9-22(10-12-23)18(25)13-29-17-7-5-16(6-8-17)24(27)28/h1-8H,9-13H2,(H,21,26)