N-[2-[(4-nitrophenyl)amino]ethyl]-2-(phenylmethylsulfanyl)ethanamide

Systemtic Name: N-[2-[(4-nitrophenyl)amino]ethyl]-2-(phenylmethylsulfanyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-[2-(4-nitroanilino)ethyl]acetamide CAS Name: N-[2-(4-nitroanilino)ethyl]-2-(phenylmethylthio)acetamide IUPAC Name: 2-benzylsulfanyl-N-[2-(4-nitroanilino)ethyl]acetamide Traditional Name: 2-(benzylthio)-N-[2-(4-nitroanilino)ethyl]acetamide Formula: C17H19N3O3S MolecularWeight: 345.41606

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC(=O)NCCNC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CSCC(=O)NCCNC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O3S/c21-17(13-24-12-14-4-2-1-3-5-14)19-11-10-18-15-6-8-16(9-7-15)20(22)23/h1-9,18H,10-13H2,(H,19,21)