4-chloranyl-N-[[2-(4-ethylphenoxy)ethanoylamino]carbamothioyl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[[2-(4-ethylphenoxy)ethanoylamino]carbamothioyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[[[2-(4-ethylphenoxy)acetyl]amino]carbamothioyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[[[2-(4-ethylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[[[2-(4-ethylphenoxy)acetyl]amino]carbamothioyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[[[2-(4-ethylphenoxy)acetyl]amino]thiocarbamoyl]-3-nitro-benzamide Formula: C18H17ClN4O5S MolecularWeight: 436.86938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC(=O)NNC(=S)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)OCC(=O)NNC(=S)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H17ClN4O5S/c1-2-11-3-6-13(7-4-11)28-10-16(24)21-22-18(29)20-17(25)12-5-8-14(19)15(9-12)23(26)27/h3-9H,2,10H2,1H3,(H,21,24)(H2,20,22,25,29)