N-[(E)-(5-ethylthiophen-3-yl)methylideneamino]-2,4-dinitro-aniline

Systemtic Name: N-[(E)-(5-ethylthiophen-3-yl)methylideneamino]-2,4-dinitro-aniline Openeye Name: N-[(E)-(5-ethyl-3-thienyl)methyleneamino]-2,4-dinitro-aniline CAS Name: N-[(E)-(5-ethyl-3-thiophenyl)methylideneamino]-2,4-dinitroaniline IUPAC Name: N-[(E)-(5-ethylthiophen-3-yl)methylideneamino]-2,4-dinitroaniline Traditional Name: (2,4-dinitrophenyl)-[(E)-(5-ethyl-3-thienyl)methyleneamino]amine Formula: C13H12N4O4S MolecularWeight: 320.32378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CS1)C=NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCC1=CC(=CS1)/C=N/NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H12N4O4S/c1-2-11-5-9(8-22-11)7-14-15-12-4-3-10(16(18)19)6-13(12)17(20)21/h3-8,15H,2H2,1H3/b14-7+