N-[2-[(2-chloranyl-4-nitro-phenyl)amino]ethyl]-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[2-[(2-chloranyl-4-nitro-phenyl)amino]ethyl]-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-[2-(2-chloro-4-nitro-anilino)ethyl]-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-[2-(2-chloro-4-nitroanilino)ethyl]-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-[2-(2-chloro-4-nitroanilino)ethyl]-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-[2-(2-chloro-4-nitro-anilino)ethyl]-2-(2-pyrimidylthio)acetamide Formula: C14H14ClN5O3S MolecularWeight: 367.81066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SCC(=O)NCCNC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CN=C(N=C1)SCC(=O)NCCNC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H14ClN5O3S/c15-11-8-10(20(22)23)2-3-12(11)16-6-7-17-13(21)9-24-14-18-4-1-5-19-14/h1-5,8,16H,6-7,9H2,(H,17,21)