ethyl 3-[[4-[(4-nitrophenyl)amino]phenyl]carbamothioylsulfanyl]propanoate

Systemtic Name: ethyl 3-[[4-[(4-nitrophenyl)amino]phenyl]carbamothioylsulfanyl]propanoate Openeye Name: ethyl 3-[[4-(4-nitroanilino)phenyl]carbamothioylsulfanyl]propanoate CAS Name: 3-[[[4-(4-nitroanilino)anilino]-sulfanylidenemethyl]thio]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[4-(4-nitroanilino)phenyl]carbamothioylsulfanyl]propanoate Traditional Name: 3-[[4-(4-nitroanilino)phenyl]thiocarbamoylthio]propionic acid ethyl ester Formula: C18H19N3O4S2 MolecularWeight: 405.49116

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCSC(=S)NC1=CC=C(C=C1)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CCSC(=S)NC1=CC=C(C=C1)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O4S2/c1-2-25-17(22)11-12-27-18(26)20-15-5-3-13(4-6-15)19-14-7-9-16(10-8-14)21(23)24/h3-10,19H,2,11-12H2,1H3,(H,20,26)