N-[4-(4-nitrophenyl)piperazin-1-yl]carbothioylbutanamide

Systemtic Name: N-[4-(4-nitrophenyl)piperazin-1-yl]carbothioylbutanamide Openeye Name: N-[4-(4-nitrophenyl)piperazine-1-carbothioyl]butanamide CAS Name: N-[[4-(4-nitrophenyl)-1-piperazinyl]-sulfanylidenemethyl]butanamide IUPAC Name: N-[4-(4-nitrophenyl)piperazine-1-carbothioyl]butanamide Traditional Name: N-[4-(4-nitrophenyl)piperazine-1-carbothioyl]butyramide Formula: C15H20N4O3S MolecularWeight: 336.4093

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N4O3S/c1-2-3-14(20)16-15(23)18-10-8-17(9-11-18)12-4-6-13(7-5-12)19(21)22/h4-7H,2-3,8-11H2,1H3,(H,16,20,23)