4-nitro-N-[3-oxidanylidene-3-(2-phenylsulfanylethylamino)propyl]benzamide

Systemtic Name: 4-nitro-N-[3-oxidanylidene-3-(2-phenylsulfanylethylamino)propyl]benzamide Openeye Name: 4-nitro-N-[3-oxo-3-(2-phenylsulfanylethylamino)propyl]benzamide CAS Name: 4-nitro-N-[3-oxo-3-[2-(phenylthio)ethylamino]propyl]benzamide IUPAC Name: 4-nitro-N-[3-oxo-3-(2-phenylsulfanylethylamino)propyl]benzamide Traditional Name: N-[3-keto-3-[2-(phenylthio)ethylamino]propyl]-4-nitro-benzamide Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCNC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)SCCNC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O4S/c22-17(19-12-13-26-16-4-2-1-3-5-16)10-11-20-18(23)14-6-8-15(9-7-14)21(24)25/h1-9H,10-13H2,(H,19,22)(H,20,23)