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4-methoxy-3-nitro-N-[2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl]benzamide

4-methoxy-3-nitro-N-[2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl]benzamide

Systemtic Name:4-methoxy-3-nitro-N-[2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl]benzamide
Openeye Name:4-methoxy-3-nitro-N-[2-oxo-2-(3-phenylsulfanylpropylamino)ethyl]benzamide
CAS Name:4-methoxy-3-nitro-N-[2-oxo-2-[3-(phenylthio)propylamino]ethyl]benzamide
IUPAC Name:4-methoxy-3-nitro-N-[2-oxo-2-(3-phenylsulfanylpropylamino)ethyl]benzamide
Traditional Name:N-[2-keto-2-[3-(phenylthio)propylamino]ethyl]-4-methoxy-3-nitro-benzamide
Formula: C19H21N3O5S
MolecularWeight: 403.45214
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCC(=O)NCCCSC2=CC=CC=C2)[N+](=O)[O-]


Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCC(=O)NCCCSC2=CC=CC=C2)[N+](=O)[O-]


InChI

InChI=1S/C19H21N3O5S/c1-27-17-9-8-14(12-16(17)22(25)26)19(24)21-13-18(23)20-10-5-11-28-15-6-3-2-4-7-15/h2-4,6-9,12H,5,10-11,13H2,1H3,(H,20,23)(H,21,24)


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