N-[(4-morpholin-4-yl-3-nitro-phenyl)carbamothioyl]benzamide

Systemtic Name: N-[(4-morpholin-4-yl-3-nitro-phenyl)carbamothioyl]benzamide Openeye Name: N-[(4-morpholino-3-nitro-phenyl)carbamothioyl]benzamide CAS Name: N-[[4-(4-morpholinyl)-3-nitroanilino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[(4-morpholin-4-yl-3-nitrophenyl)carbamothioyl]benzamide Traditional Name: N-[(4-morpholino-3-nitro-phenyl)thiocarbamoyl]benzamide Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O4S/c23-17(13-4-2-1-3-5-13)20-18(27)19-14-6-7-15(16(12-14)22(24)25)21-8-10-26-11-9-21/h1-7,12H,8-11H2,(H2,19,20,23,27)