N-[[(2-methylfuran-3-yl)carbonylamino]carbamothioyl]-2-nitro-benzamide

Systemtic Name: N-[[(2-methylfuran-3-yl)carbonylamino]carbamothioyl]-2-nitro-benzamide Openeye Name: N-[[(2-methylfuran-3-carbonyl)amino]carbamothioyl]-2-nitro-benzamide CAS Name: N-[[[(2-methyl-3-furanyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-nitrobenzamide IUPAC Name: N-[[(2-methylfuran-3-carbonyl)amino]carbamothioyl]-2-nitrobenzamide Traditional Name: N-[[(2-methyl-3-furoyl)amino]thiocarbamoyl]-2-nitro-benzamide Formula: C14H12N4O5S MolecularWeight: 348.33388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C(=O)NNC(=S)NC(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CO1)C(=O)NNC(=S)NC(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C14H12N4O5S/c1-8-9(6-7-23-8)13(20)16-17-14(24)15-12(19)10-4-2-3-5-11(10)18(21)22/h2-7H,1H3,(H,16,20)(H2,15,17,19,24)