N-[(E)-[3-bromanyl-5-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]methylideneamino]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(E)-[3-bromanyl-5-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]methylideneamino]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-[(E)-[3-bromo-5-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]methyleneamino]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[(E)-[3-bromo-5-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]methylideneamino]-2-[(4,6-dimethyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-[(E)-[3-bromo-5-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]methylideneamino]-2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-[(E)-[3-bromo-5-methoxy-4-(4-nitrobenzyl)oxy-benzylidene]amino]-2-[(4,6-dimethylpyrimidin-2-yl)thio]acetamide Formula: C23H22BrN5O5S MolecularWeight: 560.42028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NN=CC2=CC(=C(C(=C2)Br)OCC3=CC=C(C=C3)[N+](=O)[O-])OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)N/N=C/C2=CC(=C(C(=C2)Br)OCC3=CC=C(C=C3)[N+](=O)[O-])OC)C

InChI

InChI=1S/C23H22BrN5O5S/c1-14-8-15(2)27-23(26-14)35-13-21(30)28-25-11-17-9-19(24)22(20(10-17)33-3)34-12-16-4-6-18(7-5-16)29(31)32/h4-11H,12-13H2,1-3H3,(H,28,30)/b25-11+