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

Systemtic Name: 4-chloranyl-N-[[(2-methylfuran-3-yl)carbonylamino]carbamothioyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[[(2-methylfuran-3-carbonyl)amino]carbamothioyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[[[(2-methyl-3-furanyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[[(2-methylfuran-3-carbonyl)amino]carbamothioyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[[(2-methyl-3-furoyl)amino]thiocarbamoyl]-3-nitro-benzamide Formula: C14H11ClN4O5S MolecularWeight: 382.77894

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11ClN4O5S/c1-7-9(4-5-24-7)13(21)17-18-14(25)16-12(20)8-2-3-10(15)11(6-8)19(22)23/h2-6H,1H3,(H,17,21)(H2,16,18,20,25)