N-ethyl-4-(4-nitrophenyl)piperazine-1-carbothioamide

Systemtic Name: N-ethyl-4-(4-nitrophenyl)piperazine-1-carbothioamide Openeye Name: N-ethyl-4-(4-nitrophenyl)piperazine-1-carbothioamide CAS Name: N-ethyl-4-(4-nitrophenyl)-1-piperazinecarbothioamide IUPAC Name: N-ethyl-4-(4-nitrophenyl)piperazine-1-carbothioamide Traditional Name: N-ethyl-4-(4-nitrophenyl)piperazine-1-carbothioamide Formula: C13H18N4O2S MolecularWeight: 294.37262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N1CCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCNC(=S)N1CCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H18N4O2S/c1-2-14-13(20)16-9-7-15(8-10-16)11-3-5-12(6-4-11)17(18)19/h3-6H,2,7-10H2,1H3,(H,14,20)