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2-morpholin-4-yl-5-nitro-N-(quinolin-5-ylcarbamothioyl)benzamide

2-morpholin-4-yl-5-nitro-N-(quinolin-5-ylcarbamothioyl)benzamide

Systemtic Name:2-morpholin-4-yl-5-nitro-N-(quinolin-5-ylcarbamothioyl)benzamide
Openeye Name:2-morpholino-5-nitro-N-(5-quinolylcarbamothioyl)benzamide
CAS Name:2-(4-morpholinyl)-5-nitro-N-[(5-quinolinylamino)-sulfanylidenemethyl]benzamide
IUPAC Name:2-morpholin-4-yl-5-nitro-N-(quinolin-5-ylcarbamothioyl)benzamide
Traditional Name:2-morpholino-5-nitro-N-(5-quinolylthiocarbamoyl)benzamide
Formula: C21H19N5O4S
MolecularWeight: 437.47166
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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC(=S)NC3=CC=CC4=C3C=CC=N4


Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC(=S)NC3=CC=CC4=C3C=CC=N4


InChI

InChI=1S/C21H19N5O4S/c27-20(24-21(31)23-18-5-1-4-17-15(18)3-2-8-22-17)16-13-14(26(28)29)6-7-19(16)25-9-11-30-12-10-25/h1-8,13H,9-12H2,(H2,23,24,27,31)


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