4-morpholin-4-yl-3-nitro-N-[(4-piperidin-1-ylphenyl)carbamothioyl]benzamide

Systemtic Name: 4-morpholin-4-yl-3-nitro-N-[(4-piperidin-1-ylphenyl)carbamothioyl]benzamide Openeye Name: 4-morpholino-3-nitro-N-[[4-(1-piperidyl)phenyl]carbamothioyl]benzamide CAS Name: 4-(4-morpholinyl)-3-nitro-N-[[4-(1-piperidinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-morpholin-4-yl-3-nitro-N-[(4-piperidin-1-ylphenyl)carbamothioyl]benzamide Traditional Name: 4-morpholino-3-nitro-N-[(4-piperidinophenyl)thiocarbamoyl]benzamide Formula: C23H27N5O4S MolecularWeight: 469.55658

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C23H27N5O4S/c29-22(17-4-9-20(21(16-17)28(30)31)27-12-14-32-15-13-27)25-23(33)24-18-5-7-19(8-6-18)26-10-2-1-3-11-26/h4-9,16H,1-3,10-15H2,(H2,24,25,29,33)