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

Systemtic Name: 2-[(4-methylphenyl)methylsulfanyl]-N-[2-[(4-nitrophenyl)amino]ethyl]ethanamide Openeye Name: N-[2-(4-nitroanilino)ethyl]-2-(p-tolylmethylsulfanyl)acetamide CAS Name: 2-[(4-methylphenyl)methylthio]-N-[2-(4-nitroanilino)ethyl]acetamide IUPAC Name: 2-[(4-methylphenyl)methylsulfanyl]-N-[2-(4-nitroanilino)ethyl]acetamide Traditional Name: 2-[(4-methylbenzyl)thio]-N-[2-(4-nitroanilino)ethyl]acetamide Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCC(=O)NCCNC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CSCC(=O)NCCNC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O3S/c1-14-2-4-15(5-3-14)12-25-13-18(22)20-11-10-19-16-6-8-17(9-7-16)21(23)24/h2-9,19H,10-13H2,1H3,(H,20,22)