4-(4-chloranylphenoxy)-N-(morpholin-4-ylcarbamothioyl)-3-nitro-benzamide

Systemtic Name: 4-(4-chloranylphenoxy)-N-(morpholin-4-ylcarbamothioyl)-3-nitro-benzamide Openeye Name: 4-(4-chlorophenoxy)-N-(morpholinocarbamothioyl)-3-nitro-benzamide CAS Name: 4-(4-chlorophenoxy)-N-[(4-morpholinylamino)-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: 4-(4-chlorophenoxy)-N-(morpholin-4-ylcarbamothioyl)-3-nitrobenzamide Traditional Name: 4-(4-chlorophenoxy)-N-(morpholinothiocarbamoyl)-3-nitro-benzamide Formula: C18H17ClN4O5S MolecularWeight: 436.86938

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1NC(=S)NC(=O)C2=CC(=C(C=C2)OC3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1NC(=S)NC(=O)C2=CC(=C(C=C2)OC3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H17ClN4O5S/c19-13-2-4-14(5-3-13)28-16-6-1-12(11-15(16)23(25)26)17(24)20-18(29)21-22-7-9-27-10-8-22/h1-6,11H,7-10H2,(H2,20,21,24,29)