N-[3-[2-(4-nitrophenyl)sulfanylethanoylamino]phenyl]propanamide

Systemtic Name: N-[3-[2-(4-nitrophenyl)sulfanylethanoylamino]phenyl]propanamide Openeye Name: N-[3-[[2-(4-nitrophenyl)sulfanylacetyl]amino]phenyl]propanamide CAS Name: N-[3-[[2-[(4-nitrophenyl)thio]-1-oxoethyl]amino]phenyl]propanamide IUPAC Name: N-[3-[[2-(4-nitrophenyl)sulfanylacetyl]amino]phenyl]propanamide Traditional Name: N-[3-[[2-[(4-nitrophenyl)thio]acetyl]amino]phenyl]propionamide Formula: C17H17N3O4S MolecularWeight: 359.39958

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=CC=C1)NC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)NC1=CC(=CC=C1)NC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O4S/c1-2-16(21)18-12-4-3-5-13(10-12)19-17(22)11-25-15-8-6-14(7-9-15)20(23)24/h3-10H,2,11H2,1H3,(H,18,21)(H,19,22)