N-(2-nitro-5-phenylsulfanyl-phenyl)-2-pyrrolidin-1-yl-ethanamide

Systemtic Name: N-(2-nitro-5-phenylsulfanyl-phenyl)-2-pyrrolidin-1-yl-ethanamide Openeye Name: N-(2-nitro-5-phenylsulfanyl-phenyl)-2-pyrrolidin-1-yl-acetamide CAS Name: N-[2-nitro-5-(phenylthio)phenyl]-2-(1-pyrrolidinyl)acetamide IUPAC Name: N-(2-nitro-5-phenylsulfanylphenyl)-2-pyrrolidin-1-ylacetamide Traditional Name: N-[2-nitro-5-(phenylthio)phenyl]-2-pyrrolidino-acetamide Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC(=O)NC2=C(C=CC(=C2)SC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)CC(=O)NC2=C(C=CC(=C2)SC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O3S/c22-18(13-20-10-4-5-11-20)19-16-12-15(8-9-17(16)21(23)24)25-14-6-2-1-3-7-14/h1-3,6-9,12H,4-5,10-11,13H2,(H,19,22)