N-[(E)-(2-ethyl-2-phenylsulfanyl-butylidene)amino]-2,4-dinitro-aniline

Systemtic Name: N-[(E)-(2-ethyl-2-phenylsulfanyl-butylidene)amino]-2,4-dinitro-aniline Openeye Name: N-[(E)-(2-ethyl-2-phenylsulfanyl-butylidene)amino]-2,4-dinitro-aniline CAS Name: N-[(E)-[2-ethyl-2-(phenylthio)butylidene]amino]-2,4-dinitroaniline IUPAC Name: N-[(E)-(2-ethyl-2-phenylsulfanylbutylidene)amino]-2,4-dinitroaniline Traditional Name: (2,4-dinitrophenyl)-[(E)-[2-ethyl-2-(phenylthio)butylidene]amino]amine Formula: C18H20N4O4S MolecularWeight: 388.4408

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])SC2=CC=CC=C2

Isomeric SMILES

CCC(CC)(/C=N/NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])SC2=CC=CC=C2

InChI

InChI=1S/C18H20N4O4S/c1-3-18(4-2,27-15-8-6-5-7-9-15)13-19-20-16-11-10-14(21(23)24)12-17(16)22(25)26/h5-13,20H,3-4H2,1-2H3/b19-13+