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

Systemtic Name: N-[(4-morpholin-4-yl-3-nitro-phenyl)carbamothioyl]butanamide Openeye Name: N-[(4-morpholino-3-nitro-phenyl)carbamothioyl]butanamide CAS Name: N-[[4-(4-morpholinyl)-3-nitroanilino]-sulfanylidenemethyl]butanamide IUPAC Name: N-[(4-morpholin-4-yl-3-nitrophenyl)carbamothioyl]butanamide Traditional Name: N-[(4-morpholino-3-nitro-phenyl)thiocarbamoyl]butyramide Formula: C15H20N4O4S MolecularWeight: 352.4087

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC(=S)NC1=CC(=C(C=C1)N2CCOCC2)[N+](=O)[O-]

Isomeric SMILES

CCCC(=O)NC(=S)NC1=CC(=C(C=C1)N2CCOCC2)[N+](=O)[O-]

InChI

InChI=1S/C15H20N4O4S/c1-2-3-14(20)17-15(24)16-11-4-5-12(13(10-11)19(21)22)18-6-8-23-9-7-18/h4-5,10H,2-3,6-9H2,1H3,(H2,16,17,20,24)