2-chloranyl-N-[(2-morpholin-4-ylphenyl)carbamothioyl]-5-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[(2-morpholin-4-ylphenyl)carbamothioyl]-5-nitro-benzamide Openeye Name: 2-chloro-N-[(2-morpholinophenyl)carbamothioyl]-5-nitro-benzamide CAS Name: 2-chloro-N-[[2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-5-nitrobenzamide IUPAC Name: 2-chloro-N-[(2-morpholin-4-ylphenyl)carbamothioyl]-5-nitrobenzamide Traditional Name: 2-chloro-N-[(2-morpholinophenyl)thiocarbamoyl]-5-nitro-benzamide Formula: C18H17ClN4O4S MolecularWeight: 420.86998

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=CC=C2NC(=S)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1COCCN1C2=CC=CC=C2NC(=S)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H17ClN4O4S/c19-14-6-5-12(23(25)26)11-13(14)17(24)21-18(28)20-15-3-1-2-4-16(15)22-7-9-27-10-8-22/h1-6,11H,7-10H2,(H2,20,21,24,28)