N-[(E)-(2-methoxy-5-methylsulfanyl-thiophen-3-yl)methylideneamino]-2-nitro-benzamide

Systemtic Name: N-[(E)-(2-methoxy-5-methylsulfanyl-thiophen-3-yl)methylideneamino]-2-nitro-benzamide Openeye Name: N-[(E)-(2-methoxy-5-methylsulfanyl-3-thienyl)methyleneamino]-2-nitro-benzamide CAS Name: N-[(E)-[2-methoxy-5-(methylthio)-3-thiophenyl]methylideneamino]-2-nitrobenzamide IUPAC Name: N-[(E)-(2-methoxy-5-methylsulfanylthiophen-3-yl)methylideneamino]-2-nitrobenzamide Traditional Name: N-[(E)-[2-methoxy-5-(methylthio)-3-thienyl]methyleneamino]-2-nitro-benzamide Formula: C14H13N3O4S2 MolecularWeight: 351.40072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(S1)SC)C=NNC(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(S1)SC)/C=N/NC(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C14H13N3O4S2/c1-21-14-9(7-12(22-2)23-14)8-15-16-13(18)10-5-3-4-6-11(10)17(19)20/h3-8H,1-2H3,(H,16,18)/b15-8+